SCHEMBL9307464

SCHEMBL9307464

O=C(O)c1ccc2nc3ccc(C(=O)O)nn3c(=O)c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPG P10696 1/20 0.46
HSD17B10 Q99714 3/20 0.44
NPC1 O15118 7/20 0.43
RAB9A P51151 7/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
KDM4E B2RXH2 5/20 0.43
TP53 P04637 3/20 0.43
GAA P10253 3/20 0.43
CASP1 P29466 2/20 0.43
CASP7 P55210 2/20 0.43
MAPT P10636 2/20 0.43
ALOX15 P16050 1/20 0.43
HTT P42858 1/20 0.43
AKR1B1 P15121 1/20 0.43
ALDH1A1 P00352 6/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CDH1 P12830 1/20 0.40
APC P25054 1/20 0.40
CTNNB1 P35222 1/20 0.40
TCF7L2 Q9NQB0 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
SCHEMBL9309039 0.90 AKR1B1 (0.51) ALPGHSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL9307409 0.86 HSD17B10 (0.60) HSD17B10NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL9306891 0.85 SMN1; SMN2 (0.60) ALPGHSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL9305847 0.82 HSD17B10 (0.43) ALPGHSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL9306095 0.82 ALPG (0.60) ALPGHSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL9306694 0.81 SMN1; SMN2 (0.53) HSD17B10NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL9306949 0.80 P4HTM (0.51) HSD17B10NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL9306771 0.80 NTRK1 (0.59) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL9306208 0.79 NTRK1 (0.48) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL9306916 0.79 NTRK1 (0.51) HSD17B10NPC1RAB9ASMN1; SMN2KDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1994011373-A1 PYRIDAZINOQUINAZOLONE DERIVATIVES AS NEUROTROPHIC AGENTS WARNER-LAMBERT COMPANY (US) 1994-05-26 WO claimed
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