SCHEMBL9308366

SCHEMBL9308366

CCOC(=O)c1ccc2nc3cc(C(=O)OC)ccc3c(=O)n2n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
KDM4E B2RXH2 4/20 0.50
HSD17B10 Q99714 3/20 0.50
TSHR P16473 2/20 0.50
RXFP1 Q9HBX9 2/20 0.47
MAPT P10636 2/20 0.47
KMT2A Q03164 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
CASP1 P29466 1/20 0.43
LMNA P02545 3/20 0.43
POLB P06746 1/20 0.43
MMP2 P08253 1/20 0.42
MMP13 P45452 1/20 0.42
MMP14 P50281 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
TLR7 Q9NYK1 2/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL9309023 0.92 ALDH1A1 (0.46) ALDH1A1KDM4EHSD17B10RXFP1MAPT
SCHEMBL9305414 0.77 ELANE (0.45) ALDH1A1KDM4ERXFP1MAPTKMT2A
SCHEMBL9305135 0.77 MAPT (0.46) ALDH1A1KDM4EHSD17B10MAPTKMT2A
SCHEMBL9309039 0.74 AKR1B1 (0.51) ALDH1A1KDM4EHSD17B10MAPTKMT2A
SCHEMBL2118762 0.73 ALDH1A1 (0.55) ALDH1A1KDM4EHSD17B10TSHRRXFP1
SCHEMBL11637562 0.73 AKR1B1 (0.65) ALDH1A1KDM4EHSD17B10RXFP1MAPT
SCHEMBL9307792 0.71 RAB9A (0.50) ALDH1A1KDM4EHSD17B10MAPTKMT2A
SCHEMBL13343425 0.71 ALDH1A1 (0.54) ALDH1A1KDM4EHSD17B10TSHRMAPT
SCHEMBL2117475 0.69 ALDH1A1 (0.54) ALDH1A1KDM4EHSD17B10TSHRRXFP1
SCHEMBL9306585 0.67 KDM4E (0.44) ALDH1A1KDM4EHSD17B10MAPTKMT2A

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