SCHEMBL2503137

SCHEMBL2503137

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

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.41
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CYP1A2 P05177 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 2/20 0.32
HRH1 P35367 1/20 0.32
TLR8 Q9NR97 2/20 0.32
TLR7 Q9NYK1 2/20 0.32
MTOR P42345 1/20 0.31
RAB9A P51151 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL2503139 1.00 HRH3 (0.41) HRH3ALDH1A1SMN1; SMN2CYP1A2MAPK1
SCHEMBL2509168 0.98 HRH3 (0.38) HRH3ALDH1A1SMN1; SMN2CYP1A2MAPK1
SCHEMBL2509164 0.98 HRH3 (0.38) HRH3ALDH1A1SMN1; SMN2CYP1A2MAPK1
SCHEMBL2509943 0.91 GNAI3 (0.35) KDM4E
SCHEMBL2509945 0.91 GNAI3 (0.35) KDM4E
SCHEMBL2507499 0.90 HRH3 (0.34) HRH3ALDH1A1CYP1A2KDM4E
SCHEMBL2507501 0.90 HRH3 (0.34) HRH3ALDH1A1CYP1A2KDM4E
SCHEMBL2507767 0.88 HRH3 (0.42) HRH3ALDH1A1SMN1; SMN2CYP1A2MAPK1
SCHEMBL2507773 0.88 HRH3 (0.42) HRH3ALDH1A1SMN1; SMN2CYP1A2MAPK1
SCHEMBL2506747 0.88 CARM1 (0.32) HRH3ALDH1A1KDM4E

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