SCHEMBL2503308

SCHEMBL2503308

C/C=C\[Si](C)(C)CCCN1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.45
KCNH2 Q12809 2/20 0.38
HRH1 P35367 2/20 0.38
HRH4 Q9H3N8 1/20 0.37
KDM4E B2RXH2 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP1A2 P05177 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SIGMAR1 Q99720 1/20 0.36

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
SCHEMBL2503312 1.00 HRH3 (0.45) HRH3KCNH2HRH1HRH4KDM4E
SCHEMBL27821056 0.98 HRH3 (0.41) HRH3KCNH2HRH1HRH4
SCHEMBL27820889 0.94 HRH3 (0.37) HRH3KCNH2HRH1HRH4KDM4E
SCHEMBL2509162 0.90 CSNK2A2 (0.33) HRH3KCNH2CYP1A2MAPK1SIGMAR1
SCHEMBL2509158 0.90 CSNK2A2 (0.33) HRH3KCNH2CYP1A2MAPK1SIGMAR1
SCHEMBL2505458 0.89 HRH3 (0.38) HRH3KCNH2HRH1HRH4CYP1A2
SCHEMBL2505460 0.89 HRH3 (0.38) HRH3KCNH2HRH1HRH4CYP1A2
SCHEMBL2506146 0.86 CARM1 (0.35) HRH3KCNH2KDM4EL3MBTL1CYP1A2
SCHEMBL2506147 0.86 CARM1 (0.35) HRH3KCNH2KDM4EL3MBTL1CYP1A2
SCHEMBL27821059 0.82 CARM1 (0.31) HRH3

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