SCHEMBL28033381

SCHEMBL28033381

CC(C)[Si](c1cnc2cc[nH]c2c1)(C(C)C)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.42
▸ APP P05067 1/20 0.39
▸ PIK3C3 Q8NEB9 1/20 0.38
▸ ACACB O00763 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ ACACA Q13085 1/20 0.32
▸ SYK P43405 2/20 0.31
▸ ALOX5AP P20292 1/20 0.31
▸ FEN1 P39748 1/20 0.31
▸ MMP12 P39900 1/20 0.31
▸ NTRK1 P04629 1/20 0.31
▸ IRAK4 Q9NWZ3 1/20 0.31
▸ TNKS O95271 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ APOBEC3G Q9HC16 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ PRKCI P41743 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
SCHEMBL10288701 0.75 BRD4 (0.44) BRD4APPPIK3C3ACACBKCNH2
SCHEMBL24721331 0.72 BRD4 (0.42) BRD4APPPIK3C3ACACBKCNH2
SCHEMBL586478 0.72 BRD4 (0.51) BRD4APPPIK3C3SYKMMP12
SCHEMBL12896064 0.71 BRD4 (0.41) BRD4APPPIK3C3ACACBKCNH2
SCHEMBL15058223 0.70 AHR (0.47) BRD4APPPIK3C3KDM4EALDH1A1
SCHEMBL20364680 0.69 PIK3C3 (0.44) BRD4APPPIK3C3ACACBKCNH2
SCHEMBL925859 0.68 PRKCI (0.52) BRD4APPPIK3C3TNKSKDM4E
SCHEMBL418946 0.68 BRD4 (0.44) BRD4APPPIK3C3SYKALOX5AP
SCHEMBL1269027 0.68 TYR (0.45) BRD4APPPIK3C3KDM4EALDH1A1
SCHEMBL15058364 0.68 AHR (0.45) BRD4APPPIK3C3SYKALOX5AP

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
CN-102939282-B Compounds for the treatment of diseases related to amyloid or amyloid-like proteins AC IMMUNE S.A. (CH) 2015-12-02 — — CN disclosed
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