SCHEMBL313084

SCHEMBL313084

CC(=O)Oc1ccc(C(=O)Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.62
HSD17B10 Q99714 1/20 0.60
LMNA P02545 4/20 0.59
MAPT P10636 4/20 0.53
POLB P06746 2/20 0.53
PKM P14618 2/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
ESR1 P03372 1/20 0.53
PGR P06401 1/20 0.53
CHRM2 P08172 1/20 0.53
ADORA3 P0DMS8 1/20 0.53
AR P10275 1/20 0.53
CHRM1 P11229 1/20 0.53
SLC6A2 P23975 1/20 0.53
SLC6A3 Q01959 1/20 0.53
GAA P10253 2/20 0.48
ALDH1A1 P00352 1/20 0.48
HSP90AA1 P07900 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47

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
SCHEMBL5687086 0.94 HSD17B10 (0.70) ELANEHSD17B10LMNAMAPTPOLB
SCHEMBL9339013 0.84 ELANE (0.83) ELANEHSD17B10LMNAMAPTPOLB
SCHEMBL8840297 0.83 ELANE (0.46) ELANEHSD17B10LMNAMAPTKMT2A
SCHEMBL269329 0.83 LMNA (0.80) ELANEHSD17B10LMNAMAPTPOLB
SCHEMBL909307 0.83 CA12 (0.51) ELANEHSD17B10LMNAMAPTPOLB
SCHEMBL3292329 0.82 ALDH1A1 (0.43) ELANEHSD17B10MAPTKMT2AESR1
SCHEMBL5831547 0.82 ELANE (0.67) ELANEHSD17B10LMNAMAPTPOLB
SCHEMBL5831549 0.82 ELANE (0.67) ELANEHSD17B10LMNAMAPTPOLB
SCHEMBL9762610 0.82 ELANE (0.67) ELANEHSD17B10LMNAMAPTPOLB
SCHEMBL11594845 0.82 ELANE (0.47) ELANEHSD17B10MAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117085143-A PROTACs nano blocking agent for estrogen receptor and preparation method and application thereof 郑州大学 2023-11-21 CN claimed
CN-115975343-A Liquid crystal epoxy resin composite material with ultralow dielectric loss and preparation method thereof 西京学院 2023-04-18 CN claimed
US-10927101-B2 Neopetrosides A and B, and synthesis method thereof INJE UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2021-02-23 US claimed
CN-107266318-B Polysiloxane compound, method for preparing the same, and copolycarbonate resin comprising the same LG化学株式会社 2020-07-03 CN claimed
US-20190218206-A1 NEOPETROSIDES A AND B, AND SYNTHESIS METHOD THEREOF INJE UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2019-07-18 US claimed
US-9452969-B2 Polyorganosiloxane compound, method for preparing the same, and copolycarbonate resin comprising the same LG CHEM, LTD. (KR) 2016-09-27 US claimed
US-20160145187-A1 POLYORGANOSILOXANE COMPOUND, METHOD FOR PREPARING THE SAME, AND COPOLYCARBONATE RESIN COMPRISING THE SAME LG CHEM, LTD. (KR) 2016-05-26 US claimed
JP-58013560-A None JP disclosed
JP-57021352-A None JP disclosed
JP-60199859-A None JP disclosed
JP-60156646-A None JP disclosed
JP-2006412-A None JP disclosed
JP-55038309-A None JP disclosed
US-4102979-A IODINE LABEL, COCAINE HOFFMANN-LA ROCHE INC. (US) 1978-07-25 US disclosed
US-4064254-A ANTIARRHYTHMIC AND ANTISEROTONINE AGENTS MEAD JOHNSON & COMPANY (US) 1977-12-20 US disclosed
US-4041040-A Ecgonine derivative HOFFMANN-LA ROCHE INC. (US) 1977-08-09 US disclosed
US-4009208-A N,N'-HEPTAMETHYLENEBIS(4-METHOXYBENZAMIDE) STERLING DRUG INC. (US) 1977-02-22 US disclosed
US-4000143-A ANTIARRHYTHMIC AND ANTISEROTONIN AGENTS MEAD JOHNSON & COMPANY (US) 1976-12-28 US disclosed
US-3940407-A β-Adrenergic blocking agents in the 1,2,3-thiadiazole series SYNTEX (U.S.A.) INC. (US) 1976-02-24 US disclosed
US-3931195-A ANTIARRHYTHMIA, ANTISEROTONIN MEAD JOHNSON & COMPANY (US) 1976-01-06 US 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 (3 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-20190218206-A1 NEOPETROSIDES A AND B, AND SYNTHESIS METHOD THEREOF NPPA, NME4, PINK1 ELANE 2309/4885HSD17B10 3984/4885LMNA 1515/4885
US-20160145187-A1 POLYORGANOSILOXANE COMPOUND, METHOD FOR PREPARING THE SAME, AND COPOLYCARBONATE RESIN COMPRISING THE SAME PUF60, RPL38, RIOX2 ELANE 1694/4885HSD17B10 2120/4885LMNA 1101/4885
US-10927101-B2 Neopetrosides A and B, and synthesis method thereof NPPA, NME4, PINK1 ELANE 2309/4885HSD17B10 3984/4885LMNA 1515/4885

“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.