SCHEMBL7463159

SCHEMBL7463159

Cc1cc(C)c2c(Oc3ccc(F)cc3)ccnc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 2/20 0.44
PDGFRA P16234 6/20 0.43
KDR P35968 5/20 0.43
CCNC P24863 1/20 0.40
CDK8 P49336 1/20 0.40
MET P08581 5/20 0.40
AXL P30530 4/20 0.40
TRPA1 O75762 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
AURKA O14965 1/20 0.39
RIPK2 O43353 1/20 0.39
ABCB11 O95342 1/20 0.39
ABL1 P00519 1/20 0.39
EGFR P00533 1/20 0.39
ERBB2 P04626 1/20 0.39
NTRK1 P04629 1/20 0.39

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
SCHEMBL9452115 0.85 GAA (0.37) PDGFRACCNCCDK8SRCADRA1A
SCHEMBL7460149 0.77 RET (0.42) RETPDGFRAKDRCCNCCDK8
SCHEMBL14285766 0.74 RET (0.44) RETPDGFRAKDRMETAXL
Quinoxyfen SCHEMBL22257 0.74 RET (0.42) RETPDGFRAKDRMETAXL
Quinoxyfen SCHEMBL28247243 0.74 RET (0.42) RETPDGFRAKDRMETAXL
Quinoxyfen SCHEMBL7471425 0.73 RET (0.41) RETPDGFRAKDRMETAXL
Quinoxyfen SCHEMBL1974400 0.73 RET (0.41) RETPDGFRAKDRMETAXL
SCHEMBL27306670 0.72 CCNC (0.43) RETPDGFRAKDRCCNCCDK8
SCHEMBL7460943 0.71 PDGFRA (0.56) RETPDGFRAKDRMETAXL
SCHEMBL7470310 0.70 MAOA (0.38) RETPDGFRAKDRCCNCCDK8

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-5145843-A For plants DOWELANCO (US) 1992-09-08 US claimed
EP-0326330-B1 Quinoline fungicides DOW AGROSCIENCES LLC (US) 2002-07-24 EP disclosed