SCHEMBL9375675

SCHEMBL9375675

Nc1ccc2ccc(-c3ccccc3)nc2n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 2/20 0.59
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
RAB9A P51151 2/20 0.46
BACE1 P56817 2/20 0.46
ADORA2A P29274 3/20 0.46
ADORA1 P30542 2/20 0.46
AURKA O14965 1/20 0.46
HSP90AA1 P07900 1/20 0.46
PRKACA P17612 1/20 0.46
MAP2K3 P46734 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 2/20 0.42
NCF1 P14598 1/20 0.42
NOS2 P35228 1/20 0.42
NLRP3 Q96P20 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GMNN O75496 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 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
SCHEMBL12915446 0.87 MEN1 (0.59) ASIC3MEN1KMT2ARAB9AADORA2A
SCHEMBL13045285 0.85 MEN1 (0.56) ASIC3MEN1KMT2ARAB9AADORA2A
SCHEMBL13045288 0.83 MEN1 (0.54) ASIC3MEN1KMT2ARAB9AADORA2A
SCHEMBL13045287 0.81 MEN1 (0.52) ASIC3MEN1KMT2ARAB9AADORA2A
SCHEMBL10691587 0.81 BACE1 (0.50) ASIC3MEN1KMT2ARAB9ABACE1
SCHEMBL10688965 0.81 RAB9A (0.46) ASIC3MEN1KMT2ARAB9ABACE1
SCHEMBL10686271 0.80 MAPT (0.53) ASIC3MEN1KMT2ARAB9ABACE1
SCHEMBL3745861 0.80 MEN1 (0.46) ASIC3MEN1KMT2ARAB9AADORA2A
SCHEMBL22136017 0.80 ASIC3 (0.59) ASIC3MEN1KMT2ARAB9ABACE1
SCHEMBL31432891 0.80 ASIC3 (0.59) ASIC3MEN1KMT2ARAB9ABACE1

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
EP-0387568-B1 Substituted 1,8-Naphthydridines, process for their preparation and their use as antidotes BASF AG (DE) 1994-12-14 EP disclosed
US-4720500-A N-1,8-naphthyridin-2-yl amides useful as immunostimulants RHONE-POULENC SANTE (FR) 1988-01-19 US disclosed