SCHEMBL9306208

SCHEMBL9306208

O=C(Nc1ccc2nc3ccc(C(=O)O)nn3c(=O)c2c1)c1ccc(I)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.48
NGFR P08138 1/20 0.48
MLLT1 Q03111 1/20 0.41
P4HTM Q9NXG6 4/20 0.40
RAB9A P51151 5/20 0.39
NPC1 O15118 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MAPT P10636 3/20 0.39
TP53 P04637 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MCHR1 Q99705 1/20 0.39
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
CTNNB1 P35222 1/20 0.37
TCF7L2 Q9NQB0 1/20 0.37
HTT P42858 1/20 0.37

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) NTRK1NGFRP4HTMRAB9ANPC1
SCHEMBL9306771 0.90 NTRK1 (0.59) NTRK1NGFRP4HTMRAB9ANPC1
SCHEMBL9306916 0.90 NTRK1 (0.51) NTRK1NGFRP4HTMRAB9ANPC1
SCHEMBL9305603 0.86 MAPT (0.51) NTRK1NGFRP4HTMRAB9ANPC1
SCHEMBL9307464 0.79 ALPG (0.46) RAB9ANPC1SMN1; SMN2MAPTTP53
SCHEMBL9305414 0.79 ELANE (0.45) NTRK1NGFRRAB9ANPC1SMN1; SMN2
SCHEMBL9317447 0.76 NTRK1 (0.83) NTRK1NGFRP4HTMRAB9ANPC1
SCHEMBL9306585 0.75 KDM4E (0.44) NTRK1NGFRRAB9ANPC1SMN1; SMN2
SCHEMBL9306891 0.74 SMN1; SMN2 (0.60) RAB9ANPC1SMN1; SMN2MAPTTP53
SCHEMBL9309039 0.74 AKR1B1 (0.51) RAB9ANPC1SMN1; SMN2MAPTMEN1

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 claimed
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