SCHEMBL10417697

SCHEMBL10417697

CC(C)(C)[Si](OC[C@@H]1C[C@@H](O)CN1Cc1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
SMYD2 Q9NRG4 1/20 0.34
GBA1 P04062 1/20 0.34
MGAM O43451 1/20 0.34
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL7328073 1.00 MAPT (0.40) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL19900531 0.84 MAPT (0.34) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL20494834 0.84 MAPT (0.34) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL19898551 0.84 MAPT (0.34) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL19900539 0.84 MAPT (0.34) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL19898973 0.84 MAPT (0.34) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL20495587 0.84 MAPT (0.34) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL20494822 0.84 MAPT (0.34) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL13748816 0.83 SMYD2 (0.39) SMYD2MGAM
SCHEMBL23327126 0.81 CHRM2 (0.35) MAPTCHRM2CHRM4CHRM5CHRM1

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
US-4902684-A Benzazepine and benzothiazepine derivatives E. R. SQUIBB & SONS, INC. (US) 1990-02-20 US disclosed