SCHEMBL9306771

SCHEMBL9306771

O=C(Nc1ccc2nc3ccc(C(=O)O)nn3c(=O)c2c1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.59
NGFR P08138 1/20 0.59
RAB9A P51151 6/20 0.50
NPC1 O15118 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
TP53 P04637 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
MAPT P10636 1/20 0.50
P4HTM Q9NXG6 1/20 0.47
HTT P42858 1/20 0.46
PABPC1 P11940 1/20 0.46
PLAU P00749 1/20 0.46
IP6K1 Q92551 1/20 0.43
IP6K3 Q96PC2 1/20 0.43
IP6K2 Q9UHH9 1/20 0.43
BRD4 O60885 1/20 0.42
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL9306949 0.91 P4HTM (0.51) NTRK1NGFRRAB9ANPC1SMN1; SMN2
SCHEMBL9306208 0.90 NTRK1 (0.48) NTRK1NGFRRAB9ANPC1SMN1; SMN2
SCHEMBL9306916 0.90 NTRK1 (0.51) NTRK1NGFRRAB9ANPC1SMN1; SMN2
SCHEMBL9305603 0.87 MAPT (0.51) NTRK1NGFRRAB9ANPC1TP53
SCHEMBL9309118 0.81 NTRK1 (0.39) NTRK1NGFRRAB9ANPC1SMN1; SMN2
SCHEMBL9307464 0.80 ALPG (0.46) RAB9ANPC1SMN1; SMN2TP53KMT2A
SCHEMBL9305414 0.79 ELANE (0.45) NTRK1NGFRRAB9ANPC1SMN1; SMN2
SCHEMBL9309110 0.79 SCD (0.40) NTRK1NGFRRAB9ANPC1SMN1; SMN2
SCHEMBL9305847 0.78 HSD17B10 (0.43) RAB9ANPC1SMN1; SMN2TP53KMT2A
SCHEMBL9306694 0.78 SMN1; SMN2 (0.53) RAB9ANPC1SMN1; SMN2TP53KMT2A

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