SCHEMBL7909500

SCHEMBL7909500

CSc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 8/20 0.57
TSHR P16473 1/20 0.57
HTR2A P28223 1/20 0.51
SLC6A4 P31645 1/20 0.51
KCNH2 Q12809 1/20 0.51
NR1H2 P55055 1/20 0.50
BAX Q07812 1/20 0.50
MAOA P21397 1/20 0.50
CYP1A2 P05177 2/20 0.45
CYP1A1 P04798 1/20 0.45
CYP1B1 Q16678 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
PGR P06401 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PTGS2 P35354 1/20 0.42
LMNA P02545 1/20 0.42
MEN1 O00255 1/20 0.42
CYP3A4 P08684 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
SCHEMBL811091 0.94 LTA4H (0.50) LTA4HTSHRHTR2ASLC6A4KCNH2
SCHEMBL2774995 0.90 CYP1A1 (0.52) LTA4HTSHRHTR2ASLC6A4KCNH2
SCHEMBL20367054 0.89 SLC6A4 (0.47) LTA4HTSHRHTR2ASLC6A4KCNH2
SCHEMBL407203 0.81 TEAD4 (0.54) HTR2ASLC6A4KCNH2CYP1A2CYP1A1
SCHEMBL19490623 0.80 LTA4H (0.50) LTA4HTSHRHTTSMN1; SMN2MEN1
SCHEMBL5288147 0.80 KCNA3 (0.54) LTA4HSMN1; SMN2
SCHEMBL12871225 0.80 LTA4H (0.63) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL6357397 0.80 LTA4H (0.63) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL945542 0.80 LTA4H (0.63) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL16705627 0.79 CYP1A1 (0.44) LTA4HHTR2ASLC6A4KCNH2CYP1A2

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11351168-B1 2,4-disubstituted pyrimidines useful as kinase inhibitors CELGENE CAR LLC (BM) 2022-06-07 US disclosed
US-10723841-B2 Method for preparing compound and method for preparing polymer employing the same INDUSTRIAL TECHNOLOGY RESEARCH (TW) 2020-07-28 US disclosed
EP-3190139-B1 METHOD FOR PREPARING AN AROMATIC SULFIDE OR SALT THEREOF IND TECH RES INST (TW) 2019-08-28 EP disclosed
US-10329270-B2 Heteroaryl compounds as BTK inhibitors and uses thereof MERCK PATENT GMBH (DE) 2019-06-25 US disclosed
US-20190040202-A1 METHOD FOR PREPARING COMPOUND AND METHOD FOR PREPARING POLYMER EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2019-02-07 US disclosed
EP-2871180-B1 2-AMINONICOTINIC ACID ESTER DERIVATIVE AND BACTERICIDE CONTAINING SAME AS ACTIVE INGREDIENT AGRO KANESHO CO LTD (JP) 2018-03-21 EP disclosed
US-20170197914-A1 METHOD FOR PREPARING AN AROMATIC SULFIDE OR SALT THEREOF INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2017-07-13 US disclosed
US-20170197914-A1 METHOD FOR PREPARING AN AROMATIC SULFIDE OR SALT THEREOF INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2017-07-13 US disclosed
EP-3190139-A1 METHOD FOR PREPARING AN AROMATIC SULFIDE OR SALT THEREOF Industrial Technology Research Institute (TW) 2017-07-12 EP disclosed
EP-2823947-A1 Method of manufacturing electrical insulating resin material and rolling bearing JTEKT Corporation (JP) 2015-01-14 EP disclosed
CN-100573322-C The inorganic device in plane 3M INNOVATIVE PROPERTIES CO (US) 2009-12-23 CN disclosed
US-7504537-B2 Hydroxamic acid derivative and MMP inhibitor containing the same as active ingredient DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2009-03-17 US disclosed
US-7504537-B2 Hydroxamic acid derivative and MMP inhibitor containing the same as active ingredient DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2009-03-17 US disclosed
CN-1688936-A Planar inorganic device 3M INNOVATIVE PROPERTIES CO (US) 2005-10-26 CN disclosed
US-6207838-B1 ELECTROLYSIS IN LIQUID SULFUR DIOXIDE THE UNIVERSITY OF ARIZONA 2001-03-27 US disclosed
EP-1048752-A2 Electrochemically generated organothiating reagents and their use ALBEMARLE CORPORATION (US) 2000-11-02 EP disclosed
US-4120866-A REACTING AN AROMATIC COMPOUND WITH A SULFOXIDE BAYER AKTIENGESELLSCHAFT (DE) 1978-10-17 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 (5 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-20190040202-A1 METHOD FOR PREPARING COMPOUND AND METHOD FOR PREPARING POLYMER EMPLOYING THE SAME AR, C1S, C1R LTA4H 1389/4885TSHR 1497/4885HTR2A 2132/4885
US-20170197914-A1 METHOD FOR PREPARING AN AROMATIC SULFIDE OR SALT THEREOF C1S, ARSA, TST LTA4H 1495/4885TSHR 612/4885HTR2A 4009/4885
US-11351168-B1 2,4-disubstituted pyrimidines useful as kinase inhibitors DCK, CDK2, DTYMK LTA4H 3529/4885TSHR 3159/4885HTR2A 2552/4885
US-10723841-B2 Method for preparing compound and method for preparing polymer employing the same AR, C1S, C1R LTA4H 1389/4885TSHR 1497/4885HTR2A 2132/4885
US-10329270-B2 Heteroaryl compounds as BTK inhibitors and uses thereof BTK, SYK, LCK LTA4H 1446/4885TSHR 1939/4885HTR2A 2043/4885

“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.