SCHEMBL28115541

SCHEMBL28115541

c1ccc(C2CC[Si](c3ccccc3)(c3ccccc3)OC2(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 12/20 0.39
MAOA P21397 10/20 0.39
MAOB P27338 10/20 0.39
CHRM1 P11229 4/20 0.32
CHRM2 P08172 3/20 0.32
CHRM4 P08173 3/20 0.32
CHRM3 P20309 3/20 0.32
SIGMAR1 Q99720 1/20 0.32
CHRM5 P08912 2/20 0.31
RCOR1 Q9UKL0 2/20 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
SCHEMBL28272997 0.81 KDM1A (0.39) KDM1AMAOAMAOBCHRM1
SCHEMBL9100498 0.70 CHRM2 (0.50) KDM1AMAOAMAOBCHRM1CHRM2
SCHEMBL27575556 0.69 KDM1A (0.43) KDM1AMAOAMAOBCHRM1CHRM2
SCHEMBL28577296 0.65 KDM1A (0.41) KDM1AMAOAMAOB
SCHEMBL2352430 0.65 AKR1C1 (0.35)
SCHEMBL1152495 0.64 CHRM2 (0.43) KDM1AMAOAMAOBCHRM1CHRM2
SCHEMBL2048192 0.63 OPRM1 (0.36) MAOAMAOB
SCHEMBL27476971 0.62 KDM1A (0.39) KDM1AMAOAMAOB
SCHEMBL23748538 0.62 TSHR (0.33)
SCHEMBL28711657 0.62 AKR1C1 (0.30)

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-106317893-A Novel silicone rubber containing phenyl-terminated methylvinyl(tetraphenyl)phenyl 沈阳化工大学 2017-01-11 CN disclosed