SCHEMBL19070076

SCHEMBL19070076

C/C=C\c1ccc(NC)cc1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.37
APP P05067 6/20 0.36
ERBB2 P04626 1/20 0.32
MAPT P10636 2/20 0.32
SNCA P37840 1/20 0.32
MEN1 O00255 1/20 0.32
APAF1 O14727 1/20 0.32
NPC1 O15118 1/20 0.32
POLB P06746 1/20 0.32
PABPC1 P11940 1/20 0.32
MMP14 P50281 1/20 0.32
BLM P54132 1/20 0.32
CASP6 P55212 1/20 0.32
KMT2A Q03164 1/20 0.32
HMGCR P04035 1/20 0.31
CYP3A4 P08684 1/20 0.31
ITGB3 P05106 1/20 0.31
ITGB1 P05556 1/20 0.31
ITGAV P06756 1/20 0.31
ITGA2B P08514 1/20 0.31

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
SCHEMBL13787426 0.90 APP (0.40) EGFRAPPERBB2MAPTSNCA
SCHEMBL16302220 0.82 APP (0.37) EGFRAPPERBB2MAPTSNCA
SCHEMBL22059174 0.79 EGFR (0.38) EGFRAPPERBB2
SCHEMBL2766868 0.78 ALDH1A1 (0.45) EGFRAPPERBB2MAPTSNCA
SCHEMBL11132613 0.78 EGFR (0.38) EGFRAPPERBB2MAPTSNCA
SCHEMBL20824972 0.77 EGFR (0.35) EGFRAPPMAPTMEN1APAF1
SCHEMBL13344128 0.75 EGFR (0.32) EGFRAPPPOLB
SCHEMBL22828712 0.75 KIF11 (0.45) EGFRMAPTNPC1POLBITGB3
SCHEMBL675033 0.74 AMY1A (0.43) MAPTMEN1NPC1POLBKMT2A
SCHEMBL29443124 0.74 AMY1A (0.43) MAPTMEN1NPC1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3243826-B1 IMIDAZOTHIADIAZOLE AND IMIDAZOPYRAZINE DERIVATIVES AS PROTEASE ACTIVATED RECEPTOR 4 (PAR4) INHIBITORS FOR TREATING PLATELET AGGREGATION BRISTOL MYERS SQUIBB CO (US) 2019-10-30 EP disclosed
EP-2841437-B1 IMIDAZOTHIADIAZOLE AND IMIDAZOPYRAZINE DERIVATIVES AS PROTEASE ACTIVATED RECEPTOR 4 (PAR4) INHIBITORS FOR TREATING PLATELET AGGREGATION BRISTOL MYERS SQUIBB CO (US) 2017-07-05 EP disclosed