SCHEMBL2505458

SCHEMBL2505458

C/C=C\[Si](C)(C)CCN1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.38
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CARM1 Q86X55 1/20 0.34
PRMT6 Q96LA8 1/20 0.34
PRMT8 Q9NR22 1/20 0.34
KCNH2 Q12809 1/20 0.34
PSMB1 P20618 4/20 0.33
PSMB5 P28074 4/20 0.33
PSMB2 P49721 3/20 0.33
SIGMAR1 Q99720 1/20 0.33
HRH1 P35367 1/20 0.33
HRH4 Q9H3N8 1/20 0.33

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
SCHEMBL2505460 1.00 HRH3 (0.38) HRH3CYP1A2CYP3A4CARM1PRMT6
SCHEMBL2506146 0.98 CARM1 (0.35) HRH3CYP1A2CYP3A4CARM1PRMT6
SCHEMBL2506147 0.98 CARM1 (0.35) HRH3CYP1A2CYP3A4CARM1PRMT6
SCHEMBL27821059 0.94 CARM1 (0.31) HRH3CARM1PRMT6PRMT8
SCHEMBL2509252 0.90
SCHEMBL2509253 0.90
SCHEMBL2503308 0.89 HRH3 (0.45) HRH3CYP1A2KCNH2SIGMAR1HRH1
SCHEMBL2503312 0.89 HRH3 (0.45) HRH3CYP1A2KCNH2SIGMAR1HRH1
SCHEMBL27821056 0.86 HRH3 (0.41) HRH3KCNH2HRH1HRH4
SCHEMBL27820889 0.82 HRH3 (0.37) HRH3KCNH2HRH1HRH4

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
US-8304488-B2 Conjugated diene polymer, conjugated diene polymer composition, and method for producing conjugated diene polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-06 US disclosed
US-20110245408-A1 CONJUGATED DIENE POLYMER, CONJUGATED DIENE POLYMER COMPOSITION, AND METHOD FOR PRODUCING CONJUGATED DIENE POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-06 US disclosed