SCHEMBL8092372

SCHEMBL8092372

Nc1ccccc1Sc1ccc2c(/C=C/C3=CC=CCN3)nn(C3CCCCO3)c2c1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.31
DGAT2 Q96PD7 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
SCHEMBL4064833 0.85 KDR (0.40) RET
SCHEMBL4064842 0.85 KDR (0.40) RET
SCHEMBL8090796 0.84 RET (0.34) RETDGAT2
SCHEMBL8082699 0.78 CYP1A2 (0.33) DGAT2
SCHEMBL30628346 0.74 KDR (0.47) RET
SCHEMBL31249530 0.73 KDR (0.36) RET
SCHEMBL31249566 0.73 KDR (0.36) RET
SCHEMBL30585616 0.71 KDR (0.57) RETDGAT2
SCHEMBL13446211 0.71 KDR (0.57) RETDGAT2
SCHEMBL18186761 0.71 KDR (0.57) RETDGAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009036066-A1 VEGFR INHIBITORS CONTAINING A ZINC BINDING MOIETY CURIS, INC. (US) 2009-03-19 WO disclosed