SCHEMBL720468

SCHEMBL720468

Nc1cc(F)c(F)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.50
ALDH1A1 P00352 2/20 0.50
THRB P10828 2/20 0.46
TSHR P16473 2/20 0.40
TP53 P04637 1/20 0.39
CA1 P00915 4/20 0.36
CA2 P00918 4/20 0.36
BACE1 P56817 1/20 0.36
GAA P10253 1/20 0.35
CA9 Q16790 1/20 0.33
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
CASP1 P29466 1/20 0.31
RECQL P46063 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CA12 O43570 1/20 0.31
CA7 P43166 1/20 0.31
CA13 Q8N1Q1 1/20 0.31
PDE7A Q13946 1/20 0.30
NOS1 P29475 1/20 0.30

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
SCHEMBL30005190 1.00 CYP3A4 (0.50) CYP3A4ALDH1A1THRBTSHRTP53
Hydrochloric Acid SCHEMBL15573674 0.97 CYP3A4 (0.48) CYP3A4ALDH1A1THRBTSHRTP53
SCHEMBL1029756 0.86 CYP3A4 (0.58) CYP3A4ALDH1A1THRBTSHRTP53
SCHEMBL15575090 0.81 TTR (0.46) ALDH1A1THRBTSHRTP53CA1
SCHEMBL111459 0.80 CES2 (0.41) CYP3A4ALDH1A1THRBTSHRTP53
SCHEMBL31246242 0.79 CYP3A4 (0.50) CYP3A4ALDH1A1THRBTSHRTP53
SCHEMBL17964095 0.79 CYP3A4 (0.50) CYP3A4ALDH1A1THRBTSHRTP53
Bromide SCHEMBL31241400 0.77 CES2 (0.39) CYP3A4ALDH1A1TSHRTP53CA1
Iodide SCHEMBL30689240 0.77 CES2 (0.39) CYP3A4ALDH1A1TSHRTP53CA1
SCHEMBL1806961 0.75 CYP3A4 (0.46) CYP3A4ALDH1A1THRBTSHRTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025235686-A1 FLUOROCAMPTOTHECIN COMPOUNDS, CONJUGATES, AND METHODS THEREOF Aarvik Therapeutics, Inc. (US) 2025-11-13 WO disclosed
US-12391663-B2 Isoindolinone compounds MONTE ROSA THERAPEUTICS AG (CH) 2025-08-19 US disclosed
US-12161625-B2 Substituted pyrrolizine compounds and uses thereof GILEAD SCIENCES, INC. (US) 2024-12-10 US disclosed
US-20240261274-A1 TREATMENT OF MYC-DRIVEN CANCERS WITH GSPT1 DEGRADERS MONTE ROSA THERAPEUTICS AG (CH) 2024-08-08 US disclosed
US-20240083869-A1 ISOINDOLINONE COMPOUNDS MONTE ROSA THERAPEUTICS AG (CH) 2024-03-14 US disclosed
US-11912682-B2 Isoindolinone compounds MONTE ROSA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
EP-4323350-A1 ISOINDOLINONE COMPOUNDS Monte Rosa Therapeutics AG (CH) 2024-02-21 EP disclosed
US-20240051936-A1 ISOINDOLINONE COMPOUNDS MONTE ROSA THERAPEUTICS AG (CH) 2024-02-15 US disclosed
CN-117242060-A Isoindolinone compounds 蒙特罗萨医疗公司 2023-12-15 CN disclosed
US-20230391752-A1 PYRROLIDINE-3-CARBOXAMIDE DERIVATIVES AND RELATED USES CHULALONGKORN UNIVERSITY (TH) 2023-12-07 US disclosed
EP-1470121-B1 PYRIMIDINE DERIVATIVES AS RHO-KINASE INHIBITORS BAYER HEALTHCARE LLC (US) 2012-07-11 EP disclosed
US-20120053179-A1 Rho-Kinase Inhibitors NAGARATHNAM DHANAPALAN (US) 2012-03-01 US disclosed
EP-1515965-B1 PHENYLAMINOPYRIMIDINES AND THEIR USE AS RHO-KINASE INHIBITORS BAYER SCHERING PHARMA AG (DE) 2010-10-06 EP disclosed
US-20050192304-A1 Rho-kinase inhibitors BAYER HEALTHCARE LLC 2005-09-01 US disclosed
US-6924290-B2 Rho-kinase inhibitors BAYER PHARMACEUTICALS CORPORATION (US) 2005-08-02 US disclosed
EP-1515965-A1 PHENYLAMINOPYRIMIDINES AND THEIR USE AS RHO-KINASE INHIBITORS Bayer Aktiengesellschaft (DE) 2005-03-23 EP disclosed
EP-1470121-A1 PYRIMIDINE DERIVATIVES AS RHO-KINASE INHIBITORS Bayer Pharmaceuticals Corporation (US) 2004-10-27 EP disclosed
US-20040002508-A1 Antitumor agents; anticancer agents; sexual disorders; cardiovascular disorders BAYER CORPORATION 2004-01-01 US disclosed
WO-2003106450-A1 PHENYLAMINOPYRIMIDINES AND THEIR USE AS RHO-KINASE INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2003-12-24 WO disclosed
WO-2003062225-A1 PYRIMIDINE DERIVATIVES AS RHO-KINASE INHIBITORS BAYER PHARMACEUTICALS CORPORATION (US) 2003-07-31 WO 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 (10 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-20120053179-A1 Rho-Kinase Inhibitors CIT, ROCK1, ROCK2 CYP3A4 2878/4885ALDH1A1 3690/4885THRB 1531/4885
US-20230391752-A1 PYRROLIDINE-3-CARBOXAMIDE DERIVATIVES AND RELATED USES GLS2, PYGL, CPS1 CYP3A4 34/4885ALDH1A1 433/4885THRB 2570/4885
US-12161625-B2 Substituted pyrrolizine compounds and uses thereof HMBS, DHFR, HCCS CYP3A4 218/4885ALDH1A1 4332/4885THRB 4054/4885
US-12391663-B2 Isoindolinone compounds CYP4F2, AOC2, AOC3 CYP3A4 684/4885ALDH1A1 1142/4885THRB 1643/4885
US-20240083869-A1 ISOINDOLINONE COMPOUNDS CYP4F2, AOC2, AOC3 CYP3A4 684/4885ALDH1A1 1142/4885THRB 1643/4885
US-20240051936-A1 ISOINDOLINONE COMPOUNDS CRBN, CDR2, POU2F2 CYP3A4 1729/4885ALDH1A1 1907/4885THRB 2172/4885
US-11912682-B2 Isoindolinone compounds CYP4F2, AOC2, AOC3 CYP3A4 684/4885ALDH1A1 1142/4885THRB 1643/4885
US-20040002508-A1 Antitumor agents; anticancer agents; sexual disorders; cardiovascular disorders CIT, ROCK1, RHOT2 CYP3A4 2456/4885ALDH1A1 2590/4885THRB 2947/4885
US-20240261274-A1 TREATMENT OF MYC-DRIVEN CANCERS WITH GSPT1 DEGRADERS MYC, MYCBP, GSPT1 CYP3A4 4304/4885ALDH1A1 4276/4885THRB 2089/4885
US-20050192304-A1 Rho-kinase inhibitors CIT, ROCK1, ROCK2 CYP3A4 2878/4885ALDH1A1 3690/4885THRB 1531/4885

“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.