SCHEMBL16675774

SCHEMBL16675774

COc1ccc(-c2cccc(CO)c2)nc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FYN P06241 12/20 0.58
CBFB Q13951 1/20 0.53
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
CYP11B1 P15538 2/20 0.45
CYP11B2 P19099 2/20 0.45
CHEK1 O14757 1/20 0.44
CHEK2 O96017 1/20 0.44
KDM1A O60341 1/20 0.44
PRKCI P41743 1/20 0.44

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
SCHEMBL22310395 0.82 FYN (0.51) FYNCYP11B1CYP11B2PRKCI
SCHEMBL8007163 0.81 CASP3 (0.56) FYNCBFBCYP4F2CYP4A11CYP11B1
SCHEMBL1579065 0.80 FYN (0.52) FYNCHEK1CHEK2PRKCI
SCHEMBL16675790 0.80 F2RL3 (0.51) FYNCBFBCYP4F2CYP4A11CYP11B1
SCHEMBL15349769 0.80 CBFB (0.48) FYNCBFBCYP4F2CYP4A11CYP11B1
SCHEMBL16675784 0.79 FYN (0.49) FYNCHEK1CHEK2PRKCI
SCHEMBL29462100 0.79 FYN (0.49) FYNCHEK1CHEK2PRKCI
SCHEMBL20730171 0.78 FYN (0.48) FYNCYP4F2CYP4A11KDM1A
SCHEMBL1521163 0.78 ABL1 (0.58) FYNCYP11B1CYP11B2PRKCI
SCHEMBL16675751 0.77 FYN (0.52) FYNCHEK1CHEK2PRKCI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2855489-B1 IMIDAZOTHIADIAZOLE AND IMIDAZOPYRIDAZINE DERIVATIVES AS PROTEASE ACTIVATED RECEPTOR 4 (PAR4) INHIBITORS FOR TREATING PLATELET AGGREGATION BRISTOL MYERS SQUIBB CO (US) 2017-01-04 EP disclosed
US-9518064-B2 Imidazothiadiazole and imidazopyridazine derivatives as protease activated receptor 4 (PAR4) inhibitors for treating platelet aggregation BRISTOL-MYERS SQUIBB COMPANY (US) 2016-12-13 US disclosed
US-9518064-B2 Imidazothiadiazole and imidazopyridazine derivatives as protease activated receptor 4 (PAR4) inhibitors for treating platelet aggregation BRISTOL-MYERS SQUIBB COMPANY (US) 2016-12-13 US disclosed
US-20150119390-A1 IMIDAZOTHIADIAZOLE AND IMIDAZOPYRIDAZINE DERIVATIVES AS PROTEASE ACTIVATED RECEPTOR 4 (PAR4) INHIBITORS FOR TREATING PLATELET AGGREGATION BRISTOL-MYERS SQUIBB COMPANY 2015-04-30 US disclosed
US-20150119390-A1 IMIDAZOTHIADIAZOLE AND IMIDAZOPYRIDAZINE DERIVATIVES AS PROTEASE ACTIVATED RECEPTOR 4 (PAR4) INHIBITORS FOR TREATING PLATELET AGGREGATION BRISTOL-MYERS SQUIBB COMPANY 2015-04-30 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-20150119390-A1 IMIDAZOTHIADIAZOLE AND IMIDAZOPYRIDAZINE DERIVATIVES AS PROTEASE ACTIVATED RECEPTOR 4 (PAR4) INHIBITORS FOR TREATING PLATELET AGGREGATION F2RL3, F2R, F2RL1 FYN 1063/4885CBFB 4570/4885CYP4F2 685/4885

“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.