SCHEMBL10436622

SCHEMBL10436622

Cc1ccc(NC(=O)Nc2ccc(F)cc2F)cc1-c1ccnc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 4/20 0.52
HTT P42858 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
KDR P35968 3/20 0.50
GAA P10253 1/20 0.49
HTR2C P28335 1/20 0.48
HTR2B P41595 1/20 0.48
POLB P06746 1/20 0.47
MAPT P10636 2/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL10436621 0.88 PKM (0.54) PDGFRAHTTSMN1; SMN2NPC1RAB9A
SCHEMBL10436623 0.88 NPC1 (0.51) PDGFRAHTTSMN1; SMN2NPC1RAB9A
SCHEMBL10436793 0.87 PDGFRA (0.63) PDGFRASMN1; SMN2NPC1RAB9AKDR
SCHEMBL10436618 0.87 RECQL (0.54) PDGFRAHTTSMN1; SMN2NPC1RAB9A
SCHEMBL13553089 0.76 MAPT (0.45) SMN1; SMN2NPC1RAB9AKDRHTR2C
SCHEMBL15248546 0.75 HTT (0.53) HTTSMN1; SMN2NPC1RAB9AGAA
SCHEMBL15248367 0.74 HTR2A (0.64) HTTSMN1; SMN2NPC1RAB9AGAA
SCHEMBL15248602 0.74 HTR2A (0.64) HTTSMN1; SMN2NPC1RAB9AGAA
SCHEMBL10436626 0.73 NPC1 (0.46) HTTNPC1RAB9AKDRHTR2C
SCHEMBL1265323 0.72 PDE10A (0.51) PDGFRAKDR

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-0354994-A2 Quinoline derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1990-02-21 EP disclosed