SCHEMBL16675765

SCHEMBL16675765

N#Cc1ccc(-c2cccc(CO)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.56
CYP11B2 P19099 2/20 0.53
CYP11B1 P15538 1/20 0.53
MMP3 P08254 2/20 0.51
ACMSD Q8TDX5 1/20 0.47
CHEK1 O14757 1/20 0.44
EGLN2 Q96KS0 1/20 0.43
FGFR1 P11362 1/20 0.43
LOXL2 Q9Y4K0 1/20 0.42
MMP12 P39900 1/20 0.42
MMP13 P45452 1/20 0.42
KAT6A Q92794 1/20 0.42
HRH3 Q9Y5N1 2/20 0.41
IKBKB O14920 1/20 0.41
CHUK O15111 1/20 0.41
HSD11B1 P28845 1/20 0.41
HDAC8 Q9BY41 1/20 0.41

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
SCHEMBL688074 0.87 PRKCI (0.53) PRKCICYP11B2CYP11B1MMP3ACMSD
SCHEMBL18297788 0.82 PRKCI (0.76) PRKCIMMP3ACMSDFGFR1IKBKB
SCHEMBL1998639 0.82 MMP3 (0.47) CYP11B2MMP3LOXL2MMP12MMP13
SCHEMBL3721300 0.82 LOXL2 (0.62) CYP11B2MMP3FGFR1LOXL2HRH3
SCHEMBL13675358 0.82 CYP2A6 (0.57) CYP11B2MMP3FGFR1LOXL2HRH3
SCHEMBL7660410 0.82 MMP12 (0.55) PRKCIMMP3MMP12MMP13HDAC8
SCHEMBL1640956 0.81 HRH3 (0.61) HRH3
SCHEMBL12807987 0.81 MMP3 (0.58) CYP11B2CYP11B1MMP3EGLN2LOXL2
SCHEMBL16578698 0.81 PRKCI (0.68) PRKCIMMP3ACMSDFGFR1
SCHEMBL3236728 0.81 MMP3 (0.58) CYP11B2CYP11B1MMP3EGLN2LOXL2

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 3236/4885CYP11B2 1370/4885CYP11B1 1166/4885

“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.