SCHEMBL4354924

SCHEMBL4354924

[CH2]CCC(CC[CH2])c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 5/20 0.42
HTR2A P28223 5/20 0.40
TAAR1 Q96RJ0 1/20 0.40
GABBR2 O75899 2/20 0.39
GABBR1 Q9UBS5 2/20 0.39
DPP4 P27487 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
F2 P00734 1/20 0.38
TSHR P16473 1/20 0.38
MTOR P42345 1/20 0.37
RAB9A P51151 1/20 0.37
GRM7 Q14831 1/20 0.37
HIF1A Q16665 1/20 0.36
LMNA P02545 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
SCHEMBL9126415 0.90 HRH1 (0.39) HRH1HTR2ATAAR1GABBR2GABBR1
SCHEMBL3375650 0.89 AOC3 (0.42) HRH1HTR2ATAAR1LMNA
SCHEMBL2088797 0.87 CYP19A1 (0.47) HTR2ATAAR1CYP2D6SMN1; SMN2
SCHEMBL28496455 0.87 POLB (0.41) HRH1HTR2ATAAR1CYP1A2CYP2D6
SCHEMBL15061554 0.86 LMNA (0.45) HRH1HTR2ATAAR1CYP2D6LMNA
SCHEMBL536830 0.86 LMNA (0.45) HRH1HTR2ATAAR1CYP2D6LMNA
SCHEMBL6110984 0.85 POLB (0.41) HRH1HTR2ALMNA
SCHEMBL3544757 0.85 RIPK1 (0.48) TAAR1
SCHEMBL2088669 0.84 CYP19A1 (0.49) HRH1HTR2ATAAR1
SCHEMBL15563657 0.84 SIGMAR1 (0.41) HTR2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8487071-B2 Polyether polymer and production process thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-16 US disclosed
US-20110065889-A1 POLYETHER POLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-17 US disclosed
WO-2009142094-A1 POLYETHER POLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-26 WO disclosed