SCHEMBL9307409

SCHEMBL9307409

O=C(O)c1ccc2nc3ccc(Cl)cc3c(=O)n2n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.60
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 3/20 0.46
MAPK1 P28482 1/20 0.46
KDM4E B2RXH2 7/20 0.46
HTT P42858 3/20 0.46
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 6/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
HPGD P15428 3/20 0.46
CYP1A2 P05177 1/20 0.46
CASP7 P55210 5/20 0.45
PTGES O14684 1/20 0.45
ALOX5 P09917 1/20 0.45
CYP2C9 P11712 1/20 0.45
HIF1A Q16665 1/20 0.45
CASP1 P29466 4/20 0.43
NPC1 O15118 3/20 0.43

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
SCHEMBL9307464 0.86 ALPG (0.46) HSD17B10MEN1KMT2AMAPTKDM4E
SCHEMBL9306891 0.85 SMN1; SMN2 (0.60) HSD17B10MEN1KMT2AMAPTKDM4E
SCHEMBL9306949 0.83 P4HTM (0.51) HSD17B10MEN1KMT2AMAPTKDM4E
SCHEMBL9305847 0.82 HSD17B10 (0.43) HSD17B10MEN1KMT2AMAPTKDM4E
SCHEMBL9306095 0.82 ALPG (0.60) HSD17B10MAPTMAPK1KDM4EHTT
SCHEMBL9306694 0.81 SMN1; SMN2 (0.53) HSD17B10MEN1KMT2AMAPTMAPK1
SCHEMBL9309039 0.80 AKR1B1 (0.51) HSD17B10MEN1KMT2AMAPTKDM4E
SCHEMBL9307792 0.78 RAB9A (0.50) HSD17B10MEN1KMT2AMAPTKDM4E
SCHEMBL9306771 0.77 NTRK1 (0.59) MEN1KMT2AMAPTMAPK1HTT
SCHEMBL9306916 0.75 NTRK1 (0.51) HSD17B10MAPTKDM4EHTTALDH1A1

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
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
US-4250177-A ANTIALLERGENS WARNER-LAMBERT COMPANY (US) 1981-02-10 US disclosed