SCHEMBL6960166

SCHEMBL6960166

CCCCCC[Si]([O])(c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.43
KCNH2 Q12809 1/20 0.42
EPHX1 P07099 3/20 0.41
EPHX2 P34913 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
PKM P14618 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
EGFR P00533 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
SCHEMBL6963558 0.98 NAAA (0.41) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL599107 0.92 NAAA (0.38) NAAAEPHX1EPHX2ALDH1A1HTT
SCHEMBL6972289 0.84 EPHX2 (0.44) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL6970916 0.83 TP53 (0.35) NAAAALDH1A1HTTCES2CES1
SCHEMBL6965425 0.82 EPHX2 (0.42) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL23532347 0.79 KCNH2 (0.45) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL9666051 0.79 KCNH2 (0.45) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL9645735 0.79 KCNH2 (0.45) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL9664656 0.79 KCNH2 (0.45) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL9666748 0.79 KCNH2 (0.45) NAAAKCNH2EPHX1EPHX2ALDH1A1

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