SCHEMBL6960170

SCHEMBL6960170

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 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
LIPG Q9Y5X9 1/20 0.39
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
SCHEMBL6963563 0.98 NAAA (0.41) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL273784 0.92 PCSK9 (0.39) NAAAEPHX1EPHX2ALDH1A1HTT
SCHEMBL28743025 0.84 NAAA (0.43) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL11780094 0.84 NAAA (0.43) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL6972295 0.84 NAAA (0.43) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL8862115 0.84 DRD2 (0.36) NAAAEPHX1EPHX2ALDH1A1HTT
SCHEMBL271913 0.83 ESR1 (0.37) NAAAALDH1A1HTTCES2CES1
SCHEMBL11779464 0.82 NAAA (0.42) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL11781706 0.82 NAAA (0.42) NAAAKCNH2EPHX1EPHX2ALDH1A1
SCHEMBL11782714 0.82 NAAA (0.42) 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