SCHEMBL1324971

SCHEMBL1324971

O=C(Nc1cccc(OC(F)(F)F)c1)c1csc2cc(Oc3ccnc(CO)n3)ccc12

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.46
FLT1 P17948 5/20 0.46
FLT4 P35916 3/20 0.46
RET P07949 2/20 0.46
PDGFRB P09619 2/20 0.46
KIT P10721 2/20 0.46
BRAF P15056 6/20 0.42
P2RX1 P51575 1/20 0.42
NAMPT P43490 1/20 0.40

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
SCHEMBL1325243 0.89 KDR (0.59) KDRFLT1FLT4RETPDGFRB
SCHEMBL1325055 0.89 KDR (0.60) KDRFLT1FLT4RETPDGFRB
SCHEMBL1324097 0.88 KDR (0.51) KDRFLT1FLT4RETPDGFRB
SCHEMBL12124621 0.87 KDR (0.52) KDRFLT1FLT4RETPDGFRB
SCHEMBL2471560 0.87 KDR (0.61) KDRFLT1FLT4RETPDGFRB
SCHEMBL1324999 0.86 KDR (0.49) KDRFLT1FLT4RETPDGFRB
SCHEMBL1325008 0.85 KDR (0.59) KDRFLT1FLT4RETPDGFRB
SCHEMBL1324053 0.85 KDR (0.43) KDRFLT1FLT4RETPDGFRB
SCHEMBL1323994 0.84 KDR (0.42) KDRFLT1FLT4RETPDGFRB
SCHEMBL1324228 0.83 KDR (0.48) KDRFLT1FLT4RETPDGFRB

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-8058276-B2 Heterobicyclic carboxamides as inhibitors for kinases NOVARTIS AG (CH) 2011-11-15 US claimed
US-8058276-B2 Heterobicyclic carboxamides as inhibitors for kinases NOVARTIS AG (CH) 2011-11-15 US disclosed