SCHEMBL9306891

SCHEMBL9306891

Cc1ccc2nc3ccc(C(=O)O)nn3c(=O)c2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.60
NPC1 O15118 3/20 0.60
RAB9A P51151 3/20 0.60
KDM4E B2RXH2 3/20 0.60
HSD17B10 Q99714 3/20 0.60
TP53 P04637 2/20 0.60
CASP1 P29466 2/20 0.60
CASP7 P55210 2/20 0.60
GAA P10253 1/20 0.60
MAPT P10636 1/20 0.60
ALOX15 P16050 1/20 0.60
HTT P42858 1/20 0.60
ALDH1A1 P00352 4/20 0.59
NPSR1 Q6W5P4 1/20 0.59
DHODH Q02127 2/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
POLB P06746 2/20 0.41
ALPG P10696 1/20 0.40
HDAC3 O15379 2/20 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
SCHEMBL9307792 0.91 RAB9A (0.50) SMN1; SMN2NPC1RAB9AKDM4EHSD17B10
SCHEMBL9307464 0.85 ALPG (0.46) SMN1; SMN2NPC1RAB9AKDM4EHSD17B10
SCHEMBL9307409 0.85 HSD17B10 (0.60) SMN1; SMN2NPC1RAB9AKDM4EHSD17B10
SCHEMBL9306095 0.83 ALPG (0.60) SMN1; SMN2NPC1RAB9AKDM4EHSD17B10
SCHEMBL9306916 0.83 NTRK1 (0.51) SMN1; SMN2NPC1RAB9AKDM4EHSD17B10
SCHEMBL9305847 0.81 HSD17B10 (0.43) SMN1; SMN2NPC1RAB9AKDM4EHSD17B10
SCHEMBL9306694 0.80 SMN1; SMN2 (0.53) SMN1; SMN2NPC1RAB9AKDM4EHSD17B10
SCHEMBL9309039 0.78 AKR1B1 (0.51) SMN1; SMN2NPC1RAB9AKDM4EHSD17B10
SCHEMBL9306771 0.76 NTRK1 (0.59) SMN1; SMN2NPC1RAB9ATP53MAPT
SCHEMBL9306585 0.75 KDM4E (0.44) SMN1; SMN2NPC1RAB9AKDM4EHSD17B10

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-5340808-A Fused pyridazinoquinazolone derivatives as neurotrophic agents WARNER LAMBERT COMPANY (US) 1994-08-23 US disclosed
WO-1994011373-A1 PYRIDAZINOQUINAZOLONE DERIVATIVES AS NEUROTROPHIC AGENTS WARNER-LAMBERT COMPANY (US) 1994-05-26 WO disclosed