SCHEMBL18756038

SCHEMBL18756038

CS(=O)OCc1cc(Oc2ccc3c(c2)CCN3C(=O)Nc2cccc(C(F)(F)F)c2)ncn1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 16/20 0.52
RIPK1 Q13546 1/20 0.50
HTR2A P28223 3/20 0.48
HTR2C P28335 3/20 0.48
HTR2B P41595 2/20 0.48
RET P07949 1/20 0.48
PDGFRB P09619 1/20 0.48
KIT P10721 1/20 0.48
FLT1 P17948 1/20 0.48
FLT4 P35916 1/20 0.48
MAPK14 Q16539 12/20 0.46
TNNI3K Q59H18 12/20 0.46
BRAF P15056 11/20 0.46

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
SCHEMBL2792969 0.89 KDR (0.53) KDRRIPK1HTR2AHTR2CHTR2B
SCHEMBL11966503 0.88 KDR (0.66) KDRRIPK1HTR2AHTR2CHTR2B
SCHEMBL11966506 0.88 KDR (0.57) KDRRIPK1HTR2AHTR2CHTR2B
SCHEMBL11966504 0.88 KDR (0.68) KDRRIPK1HTR2AHTR2CHTR2B
SCHEMBL11966514 0.87 KDR (0.54) KDRRIPK1HTR2AHTR2CHTR2B
SCHEMBL11966501 0.87 KDR (0.52) KDRRIPK1HTR2AHTR2CHTR2B
SCHEMBL11966508 0.86 KDR (0.54) KDRRIPK1HTR2AHTR2CHTR2B
SCHEMBL11966509 0.86 KDR (0.54) KDRRIPK1HTR2AHTR2CHTR2B
SCHEMBL11966510 0.86 KDR (0.53) KDRRIPK1HTR2AHTR2CHTR2B
SCHEMBL11966512 0.86 KDR (0.57) KDRRIPK1HTR2AHTR2CHTR2B

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
EP-2376478-B1 PYRIDYLOXYINDOLES INHIBITORS OF VEGF-R2 AND USE THEREOF FOR TREATMENT OF DISEASE NOVARTIS AG (CH) 2017-04-19 EP disclosed