SCHEMBL6965425

SCHEMBL6965425

CCCCC[Si]([O])(CCCCC)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.42
PKM P14618 1/20 0.42
NAAA Q02083 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
KCNH2 Q12809 1/20 0.39
CES2 O00748 2/20 0.39
CES1 P23141 2/20 0.39
EPHX1 P07099 3/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.39
HPGD P15428 1/20 0.38

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
SCHEMBL6972289 0.98 EPHX2 (0.44) EPHX2PKMNAAASMN1; SMN2KCNH2
SCHEMBL6963975 0.94 SMN1; SMN2 (0.41) EPHX2PKMNAAASMN1; SMN2CES2
SCHEMBL6957948 0.85 NAAA (0.36) EPHX2PKMNAAASMN1; SMN2CES2
SCHEMBL6963558 0.83 NAAA (0.41) EPHX2PKMNAAAKCNH2CES2
SCHEMBL6960166 0.82 NAAA (0.43) EPHX2PKMNAAAKCNH2CES2
SCHEMBL3982887 0.78 AR (0.43) EPHX2NAAAKCNH2CES2CES1
SCHEMBL23532347 0.77 KCNH2 (0.45) EPHX2PKMNAAASMN1; SMN2KCNH2
SCHEMBL9666748 0.77 KCNH2 (0.45) EPHX2PKMNAAASMN1; SMN2KCNH2
SCHEMBL16210120 0.77 KCNH2 (0.45) EPHX2PKMNAAASMN1; SMN2KCNH2
SCHEMBL9666446 0.77 KCNH2 (0.45) EPHX2PKMNAAASMN1; SMN2KCNH2

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