SCHEMBL1019300

SCHEMBL1019300

CCCCCCCOc1ccc(C(=O)Cl)cc1

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.73
TSHR P16473 1/20 0.73
PLA2G4B P0C869 6/20 0.71
RARB P10826 3/20 0.67
PLA2G4A P47712 1/20 0.63
GAA P10253 2/20 0.61
NR5A1 Q13285 1/20 0.61
THRA P10827 2/20 0.60
THRB P10828 2/20 0.60
NPC1 O15118 1/20 0.58
LMNA P02545 1/20 0.58
MAPT P10636 1/20 0.58
ALOX15 P16050 1/20 0.58
RAB9A P51151 1/20 0.58
HSD17B10 Q99714 1/20 0.58

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
SCHEMBL5053280 1.00 TP53 (0.73) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL5206359 1.00 TP53 (0.73) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL2387345 1.00 TP53 (0.73) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL2399489 1.00 TP53 (0.73) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL1022325 1.00 TP53 (0.73) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL8728342 1.00 TP53 (0.73) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL9161795 1.00 TP53 (0.73) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL10045771 1.00 TP53 (0.73) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL4209056 1.00 TP53 (0.73) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL1023839 0.98 TP53 (0.70) TP53TSHRPLA2G4BRARBPLA2G4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0440329-A1 S-substituted carbonyl substituted betathioacrylamide biocides and fungicides ROHM AND HAAS COMPANY (US) 1991-08-07 EP claimed
US-9700543-B2 GLP-1 receptor stabilizers and modulators CELGENE INTERNATIONAL II SÀRL (CH) 2017-07-11 US disclosed
EP-2713722-B1 NOVEL GLP-1 RECEPTOR STABILIZERS AND MODULATORS RECEPTOS LLC (US) 2017-03-15 EP disclosed
US-20160310471-A1 NOVEL GLP-1 RECEPTOR STABILIZERS AND MODULATORS RECEPTOS LLC 2016-10-27 US disclosed
US-9422231-B2 Method for inhibiting Trypanosoma cruzi HOWARD UNIVERSITY (US) 2016-08-23 US disclosed
US-9278910-B2 GLP-1 receptor stabilizers and modulators RECEPTOS, INC. (US) 2016-03-08 US disclosed
US-20150073177-A1 METHOD FOR INHIBITING TRYPANOSOMA CRUZI HOWARD UNIVERRSITY (US) 2015-03-12 US disclosed
US-20140336185-A1 NOVEL GLP-1 RECEPTOR STABILIZERS AND MODULATORS RECEPTOS LLC 2014-11-13 US disclosed
US-20140336187-A1 METHODS FOR TREATING LEISHMANIASIS HOWARD UNIVERSITY 2014-11-13 US disclosed
US-8816121-B2 GLP-1 receptor stabilizers and modulators RECEPTOS, INC. (US) 2014-08-26 US disclosed
EP-0248335-A2 Chiral esters of alpha-substituted carboxylic acids and mesogeneous pyrimidine-5-yl-phenols, and their use as dopants in liquid-crystal phases HOECHST AKTIENGESELLSCHAFT (DE) 1987-12-09 EP disclosed
EP-0218728-A1 PHENYLENE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1987-04-22 EP disclosed
WO-1986005779-A1 PHENYLENE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1986-10-09 WO disclosed
US-4481149-A LIQUID CRYSTALS DAIKIN KOGYO CO., LTD. (JP) 1984-11-06 US disclosed
US-4393231-A LIQUID CRYSTALS DAIKIN KOGYO CO., LTD. (JP) 1983-07-12 US disclosed
US-4308162-A Novel yellow azo dyes and dichroic liquid crystal compositions made therewith GENERAL ELECTRIC COMPANY (US) 1981-12-29 US disclosed
US-4308161-A FOR UPGRADING BLACK COLOR OF BLACK LIQUID CRYSTAL DISPLAYS GENERAL ELECTRIC COMPANY (US) 1981-12-29 US disclosed
US-4308164-A Novel yellow azo dyes and dichroic liquid crystal composition made therewith GENERAL ELECTRIC COMPANY (US) 1981-12-29 US disclosed
US-4308163-A IMPROVING BLACK COLOR OF DICHROIC DYES GENERAL ELECTRIC COMPANY (US) 1981-12-29 US disclosed
US-4029594-A Novel liquid crystal compounds and electro-optic devices incorporating them RCA CORPORATION (US) 1977-06-14 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 (4 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-20140336185-A1 NOVEL GLP-1 RECEPTOR STABILIZERS AND MODULATORS GLP1R, GIPR, GHSR TP53 3447/4885TSHR 31/4885PLA2G4B 2051/4885
US-20140336187-A1 METHODS FOR TREATING LEISHMANIASIS LSS, CYP51A1, NQO1 TP53 3885/4885TSHR 3995/4885PLA2G4B 2124/4885
US-20150073177-A1 METHOD FOR INHIBITING TRYPANOSOMA CRUZI PCNA, NQO1, NQO2 TP53 3360/4885TSHR 2579/4885PLA2G4B 2643/4885
US-20160310471-A1 NOVEL GLP-1 RECEPTOR STABILIZERS AND MODULATORS GLP1R, GIPR, GHSR TP53 3447/4885TSHR 31/4885PLA2G4B 2051/4885

“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.