SCHEMBL2733599

SCHEMBL2733599

CC[SiH](C)c1ccc(C)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 5/20 0.35
IDO1 P14902 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
AGXT P21549 2/20 0.31
TSHR P16473 3/20 0.31
LMNA P02545 1/20 0.30
ALOX12 P18054 1/20 0.30
SRD5A2 P31213 1/20 0.30

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
SCHEMBL8045786 0.89
SCHEMBL15959321 0.76 ACHE (0.44) ACHETDP1ALDH1A1IDO1SMN1; SMN2
SCHEMBL2229742 0.76 TP53 (0.39) ACHEALDH1A1TSHRLMNAALOX12
SCHEMBL31216241 0.73 HTT (0.42) ACHETDP1ALDH1A1MAPTCYP1A2
SCHEMBL20958703 0.72 ALDH1A1 (0.48) TDP1ALDH1A1TSHR
SCHEMBL9617383 0.72 NQO1 (0.61) TDP1ALDH1A1SMN1; SMN2MAPTCA1
SCHEMBL8385547 0.71 ACHE (0.53) ACHETDP1ALDH1A1IDO1SMN1; SMN2
SCHEMBL1049035 0.71 ACHE (0.53) ACHETDP1ALDH1A1IDO1SMN1; SMN2
SCHEMBL476102 0.71 ACHE (0.53) ACHETDP1ALDH1A1IDO1SMN1; SMN2
SCHEMBL23446938 0.70 ACHE (0.33) ACHETDP1ALDH1A1SMN1; SMN2

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-2318477-A1 ADDITIVES TO PREVENT DEGRADATION OF CYCLIC ALKENE DERIVATIVES FujiFilm Electronic Materials USA, Inc. (US) 2011-05-11 EP disclosed
WO-2010005937-A1 ADDITIVES TO PREVENT DEGRADATION OF CYCLIC ALKENE DERIVATIVES FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2010-01-14 WO disclosed