SCHEMBL2509150

SCHEMBL2509150

C[SiH](C)C=CCCCN1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.46
CYP1A2 P05177 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
HRH1 P35367 1/20 0.35
MAPT P10636 2/20 0.34
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
PRMT8 Q9NR22 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
SCHEMBL2501227 0.88 HRH3 (0.39) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL2502004 0.86 CARM1 (0.37) HRH3CYP1A2ALDH1A1TSHRMAPT
SCHEMBL2509320 0.81 HRH3 (0.43) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL2500658 0.79 HRH3 (0.40) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL3381213 0.75 LTA4H (0.33) HRH3SIGMAR1CARM1PRMT6PRMT8
SCHEMBL21862177 0.75 HRH3 (0.48) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL2967773 0.72 CYP1A2 (0.53) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL2967775 0.72 CYP1A2 (0.53) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL9111692 0.71 HRH3 (0.48) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL9111689 0.71 HRH3 (0.48) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1

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