SCHEMBL7819280

SCHEMBL7819280

COc1ccc(C[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.57
CA4 P22748 1/20 0.48
SIGMAR1 Q99720 1/20 0.47
IDO1 P14902 2/20 0.45
HTT P42858 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
USP2 O75604 1/20 0.42
TP53 P04637 1/20 0.42
AGXT P21549 1/20 0.42
TRPA1 O75762 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
HIF1A Q16665 1/20 0.42
FPR2 P25090 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL4598689 0.98 LTA4H (0.55) LTA4HCA4SIGMAR1IDO1HTT
SCHEMBL18876993 0.92 LTA4H (0.57) LTA4HCA4SIGMAR1HTTNPC1
SCHEMBL19337297 0.85 APP (0.57) LTA4HNPC1RAB9A
SCHEMBL837713 0.83 CALM1 (0.36) IDO1TP53TRPA1TAAR1MIF
SCHEMBL24055086 0.83 SMN1; SMN2 (0.44) LTA4HIDO1NPC1RAB9ATP53
SCHEMBL7196443 0.83 ACHE (0.56) LTA4HIDO1NPC1RAB9AAGXT
SCHEMBL5083307 0.83 TSHR (0.47) LTA4HCA4SIGMAR1HIF1A
SCHEMBL24055085 0.81 IDO1 (0.42) LTA4HIDO1TP53AGXTTAAR1
SCHEMBL7652603 0.81 LTA4H (0.53) LTA4HSIGMAR1NPC1RAB9ATP53
Bromide SCHEMBL16180511 0.81 TSHR (0.46) LTA4HCA4SIGMAR1HIF1A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117362160-A Synthesis method of stilbene derivative Z-configuration isomer 广东克冠达医药科技有限公司 2024-01-09 CN disclosed
US-11858889-B2 Compound for modulating DDAH and ADMA levels, as well as methods of using thereof to treat disease THE TRUSTEES OF INDIANA UNIVERSITY (US) 2024-01-02 US disclosed
US-20230180761-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2023-06-15 US disclosed
US-20180098541-A1 MOLECULES HAVEING PESTICIDAL UTILIY AND INTERMEDIATES, COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2018-04-12 US disclosed
US-20180007911-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2018-01-11 US disclosed
US-20180000087-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2018-01-04 US disclosed
US-20170339961-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2017-11-30 US disclosed
US-9795139-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2017-10-24 US disclosed
US-9781935-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2017-10-10 US disclosed
US-20170075219-A1 ONIUM SALT, PHOTOACID GENERATOR, PHOTOSENSITIVE RESIN COMPOSITION, AND METHOD FOR PRODUCING DEVICE TOYO GOSEI CO., LTD. (JP) 2017-03-16 US disclosed
EP-1847576-A1 Ink composition, inkjet recording method, printed material, process for producing lithographic printing plate, and lithographic printing plate FUJIFILM Corporation (JP) 2007-10-24 EP disclosed
US-20070242120-A1 Ink composition, inkjet recording method, printed material, process for producing lithographic printing plate, and lithographic printing plate FUJIFILM CORPORATION (JP) 2007-10-18 US disclosed
CN-1257894-C Phenylethenyl or phenylethynyl derivatives as glutamate receptor antagonists HOFFMANN LA ROCHE (CH) 2006-05-31 CN disclosed
CN-1478080-A Phenylethenyl or phenylethinyl derivatives as glutamate receptor antagonists - 2004-02-25 CN disclosed
EP-0734379-B1 2-ARYLALKENYL-AZACYCLOALKANE DERIVATIVES AS SIGMA RECEPTOR LIGANDS, PREPARATION METHOD THEREFOR AND THERAPEUTICAL USE THEREOF PARKE DAVIS (FR) 2001-03-07 EP disclosed
EP-0995436-A2 Ligands for sigma receptors and their therapeutical applications PARKE-DAVIS (FR) 2000-04-26 EP disclosed
EP-0734379-A1 NOVEL 2-ARYLALKENYL-AZACYCLOALKANE DERIVATIVES AS SIGMA RECEPTOR LIGANDS, PREPARATION METHOD THEREFOR AND THERAPEUTICAL USE THEREOF INSTITUT DE RECHERCHE JOUVEINAL (I.R.J) (FR) 1996-10-02 EP disclosed
WO-1995015948-A1 NOVEL 2-ARYLALKENYL-AZACYCLOALKANE DERIVATIVES AS SIGMA RECEPTOR LIGANDS, PREPARATION METHOD THEREFOR AND THERAPEUTICAL USE THEREOF INSTITUT DE RECHERCHE JOUVEINAL (FR) 1995-06-15 WO disclosed
CN-1024796-C Process for preparing bicyclic peroxide compounds HOFFMANN LA ROCHE (CH) 1994-06-01 CN disclosed
CN-1033630-A bicyclic peroxide and preparation method thereof HOFFMANN LA ROCHE (CH) 1989-07-05 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180098541-A1 MOLECULES HAVEING PESTICIDAL UTILIY AND INTERMEDIATES, COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, MLYCD LTA4H 1199/4885CA4 1496/4885SIGMAR1 3350/4885
US-20180000087-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto ACHE, DDT, MLYCD LTA4H 553/4885CA4 1651/4885SIGMAR1 3628/4885
US-11858889-B2 Compound for modulating DDAH and ADMA levels, as well as methods of using thereof to treat disease ADM2, DDAH1, BHMT LTA4H 192/4885CA4 3551/4885SIGMAR1 3032/4885
US-20230180761-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO ACHE, DDT, MLYCD LTA4H 553/4885CA4 1651/4885SIGMAR1 3628/4885
US-20170339961-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto ACHE, DDT, MLYCD LTA4H 553/4885CA4 1651/4885SIGMAR1 3628/4885
US-20180007911-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto ACHE, DDT, MLYCD LTA4H 553/4885CA4 1651/4885SIGMAR1 3628/4885
US-20170075219-A1 ONIUM SALT, PHOTOACID GENERATOR, PHOTOSENSITIVE RESIN COMPOSITION, AND METHOD FOR PRODUCING DEVICE ARCN1, ZYX, NPY1R LTA4H 2753/4885CA4 881/4885SIGMAR1 1195/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.