SCHEMBL2660451

SCHEMBL2660451

CC(=O)OCc1cccc(C(F)(F)F)c1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.63
PRKCD Q05655 1/20 0.63
MAOB P27338 4/20 0.62
MMP1 P03956 1/20 0.59
MMP12 P39900 1/20 0.59
IDO1 P14902 2/20 0.58
MAPT P10636 1/20 0.58
HTT P42858 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
ALDH1A1 P00352 1/20 0.56
NR4A2 P43354 2/20 0.56
FFAR4 Q5NUL3 2/20 0.52
FFAR1 O14842 1/20 0.52
ACP3 P15309 1/20 0.51
MRGPRX4 Q96LA9 1/20 0.51
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49

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
SCHEMBL20267723 0.87 IDO1 (0.62) PRKCAPRKCDMAOBMMP1MMP12
SCHEMBL10005902 0.85 ALDH1A1 (0.58) PRKCAPRKCDMAOBMMP1MMP12
SCHEMBL2030657 0.85 PRKCA (0.58) PRKCAPRKCDMAOBMMP1MMP12
SCHEMBL11739403 0.85 PRKCA (0.58) PRKCAPRKCDMAOBMMP1MMP12
SCHEMBL23049789 0.84 PRKCA (0.60) PRKCAPRKCDMAOBMMP1MMP12
SCHEMBL6310724 0.84 PRKCA (0.60) PRKCAPRKCDMAOBMMP1MMP12
SCHEMBL8789673 0.84 ALOX5 (0.56) PRKCAPRKCDMAOBMMP1MMP12
SCHEMBL27925866 0.84 PRKCA (0.60) PRKCAPRKCDMAOBMMP1MMP12
SCHEMBL9405203 0.84 PRKCA (0.63) PRKCAPRKCDMAOBMMP1MMP12
SCHEMBL27854715 0.84 PRKCA (0.63) PRKCAPRKCDMAOBMMP1MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111295373-B Compositions and methods for treating brain injury 阿泽凡药物公司 2024-12-10 CN disclosed
CN-102656168-B Polycyclic compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS INC 2015-04-01 CN disclosed
CN-102770415-B Polycyclic compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS INC 2014-09-24 CN disclosed
CN-102770415-A Polycyclic compounds as lysophosphatidic acid receptor antagonists AMIRA PHARMACEUTICALS INC 2012-11-07 CN disclosed
CN-1852712-B Dual NK1/NK3 antagonists for treating schizophrenia HOFFMANN LA ROCHE 2010-06-09 CN disclosed
CN-101448844-A Thiazolo-pyramidine / pyridine urea derivatives as adenosine a2b receptor antagonists HOFFMANN LA ROCHE (CH) 2009-06-03 CN disclosed
CN-101374813-A Arylsulfonamide and sulfonyl compounds as PPAR modulators and methods of treating metabolic disorders KALYPSYS INC (US) 2009-02-25 CN disclosed
EP-1385508-B1 DIPEPTIDYL PEPTIDASE INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES MERCK & CO INC (US) 2008-05-21 EP disclosed
CN-1852712-A Dual NK1/NK3 antagonists for treating schizophrenia HOFFMANN LA ROCHE (CH) 2006-10-25 CN disclosed
US-20040097557-A1 Cyanothiophene derivatives, compositions containing such compounds and methods of use DUFFY JOSEPH L (US) 2004-05-20 US disclosed
US-4328355-A ANTIFERTILITY AGENTS G. D. SEARLE & CO. (US) 1982-05-04 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 (1 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-20040097557-A1 Cyanothiophene derivatives, compositions containing such compounds and methods of use GLP1R, GPR119, GCGR PRKCA 2083/4885PRKCD 2650/4885MAOB 1594/4885

“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.