SCHEMBL6966052

SCHEMBL6966052

[CH2]CC(=O)OC(C)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.53
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45
TSHR P16473 1/20 0.44
LPAR1 Q92633 3/20 0.43
FFAR1 O14842 1/20 0.43
ALDH1A1 P00352 2/20 0.41
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
OPRM1 P35372 3/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.39
LPAR3 Q9UBY5 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL3883004 0.85 HCAR2 (0.56) HCAR2KDM4EMAPTTSHRLPAR1
SCHEMBL11461421 0.85 HCAR2 (0.56) HCAR2KDM4EMAPTTSHRLPAR1
SCHEMBL9231000 0.83 HCAR2 (0.54) HCAR2KDM4EMAPTTSHRLPAR1
SCHEMBL538486 0.83 HCAR2 (0.54) HCAR2KDM4EMAPTTSHRLPAR1
SCHEMBL27774184 0.83 HCAR2 (0.54) HCAR2KDM4EMAPTTSHRLPAR1
SCHEMBL27701745 0.83 HCAR2 (0.54) HCAR2KDM4EMAPTTSHRLPAR1
SCHEMBL28472584 0.81 HCAR2 (0.53) HCAR2KDM4EMAPTTSHRLPAR1
SCHEMBL29016877 0.81 HCAR2 (0.53) HCAR2KDM4EMAPTTSHRLPAR1
SCHEMBL1054349 0.81 HCAR2 (0.53) HCAR2KDM4EMAPTTSHRLPAR1
SCHEMBL1766149 0.81 HCAR2 (0.53) HCAR2KDM4EMAPTTSHRLPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed