SCHEMBL8489174

SCHEMBL8489174

Cc1cnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2c1NC(=O)Nc1cccc(Br)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.42
PTGER3 P43115 1/20 0.41
KDR P35968 6/20 0.41
NPSR1 Q6W5P4 1/20 0.40
GRIK1 P39086 2/20 0.40
GRIK2 Q13002 2/20 0.40
STING1 Q86WV6 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
PDGFRB P09619 2/20 0.39
KIT P10721 2/20 0.39
FLT1 P17948 2/20 0.39
FLT4 P35916 2/20 0.39
RAF1 P04049 1/20 0.39
TYK2 P29597 2/20 0.39
EGFR P00533 1/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
F2R P25116 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
SCHEMBL8486154 0.90 NPC1 (0.47) TRPV1KDRNPSR1LMNAPOLB
SCHEMBL8490721 0.90 TRPV1 (0.43) TRPV1PTGER3NPSR1LMNAPOLB
SCHEMBL8489178 0.89 MAPT (0.45) TRPV1NPSR1LMNAPOLBTYK2
SCHEMBL8486434 0.89 SMN1; SMN2 (0.47) TRPV1PTGER3NPSR1LMNAPOLB
SCHEMBL8486703 0.86 NPSR1 (0.46) TRPV1KDRNPSR1LMNAPOLB
SCHEMBL8487940 0.86 HTT (0.52) NPSR1LMNATYK2
SCHEMBL8486950 0.85 KMT2A (0.48) TRPV1POLBTYK2JAK2JAK1
SCHEMBL8487714 0.85 NPSR1 (0.44) TRPV1NPSR1POLBTYK2JAK2
SCHEMBL8584811 0.84 TRPV1 (0.50) TRPV1NPSR1LMNAPOLB
SCHEMBL8490225 0.84 TYK2 (0.41) KDRNPSR1LMNAPOLBTYK2

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-1999021835-A1 QUINOLINE DERIVATIVES AS H+-ATPase INHIBITORS AND AS BONE RESORPTION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-05-06 WO disclosed