SCHEMBL16675773

SCHEMBL16675773

Cc1ccc(-c2cccc(CO)c2)c(F)n1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.45
DHODH Q02127 4/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
MAP2K4 P45985 1/20 0.41
FYN P06241 1/20 0.40
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA7 P36544 1/20 0.39
LRRK2 Q5S007 1/20 0.39
CDK8 P49336 1/20 0.39
CALML3 P27482 1/20 0.38
HTR7 P34969 1/20 0.38
NPY5R Q15761 1/20 0.38
MTOR P42345 1/20 0.37
VSIR Q9H7M9 1/20 0.37

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
SCHEMBL15726492 0.84 PRKCI (0.47) PRKCIMAP2K4FYNCHRNB4CHRNA3
SCHEMBL11372275 0.76 AOC3 (0.60)
SCHEMBL16726970 0.75 PRKCI (0.44) PRKCIMAP2K4FYNCALML3HTR7
SCHEMBL16675779 0.75 PRKCI (0.51) PRKCIDHODHMAP2K4FYNCHRNB4
SCHEMBL10981826 0.74 HTR7 (0.65) PRKCIMAP2K4HTR7VSIR
SCHEMBL15928353 0.73 FYN (0.45) PRKCIABCG2MAP2K4FYNCHRNB4
SCHEMBL16675753 0.71 CALML3 (0.49) PRKCIFYNCHRNB4CHRNA3CHRNA7
SCHEMBL6029518 0.71 PRKCI (0.46) PRKCIMAP2K4FYNCHRNB4CHRNA3
SCHEMBL3452137 0.71 MAP2K4 (0.51) PRKCIMAP2K4FYNCHRNB4CHRNA3
SCHEMBL13562430 0.71 PRKCI (0.46) PRKCIMAP2K4FYNCHRNB4CHRNA3

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 PRKCI 3236/4885DHODH 3416/4885ABCG2 816/4885

“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.