SCHEMBL6607775

SCHEMBL6607775

CNc1c2c(nc3ccc(OC)cc13)CCNC2

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 17/20 0.52
BCHE P06276 14/20 0.52
PDE5A O76074 2/20 0.49
CHRM1 P11229 1/20 0.49
GRIN1 Q05586 3/20 0.48
GRIN2A Q12879 3/20 0.48
APP P05067 1/20 0.48

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
SCHEMBL6609348 0.82 MAPT (0.61) ACHEBCHEPDE5AGRIN1GRIN2A
SCHEMBL6608783 0.82 ACHE (0.68) ACHEBCHECHRM1GRIN1GRIN2A
SCHEMBL16401333 0.82 ACHE (0.54) ACHEBCHEPDE5ACHRM1GRIN1
SCHEMBL6605996 0.82 BCHE (0.45) ACHEBCHEPDE5AGRIN1GRIN2A
SCHEMBL6609155 0.79 MAPT (0.47) ACHEBCHEAPP
SCHEMBL11828040 0.77 ACHE (0.53) ACHEBCHECHRM1GRIN1GRIN2A
SCHEMBL11848739 0.77 ACHE (0.56) ACHEBCHECHRM1GRIN1GRIN2A
SCHEMBL24844122 0.71 EHMT2 (0.73) ACHEBCHEGRIN1GRIN2A
SCHEMBL30064006 0.71 EHMT2 (0.70) ACHEBCHECHRM1
SCHEMBL24843945 0.71 EHMT2 (0.70) ACHEBCHECHRM1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0997462-A1 NOVEL NAPHTHYRIDINE DERIVATIVES OR SALTS THEREOF Nippon Kayaku Kabushiki Kaisha (JP) 2000-05-03 EP claimed
EP-0997462-B1 NOVEL NAPHTHYRIDINE DERIVATIVES OR SALTS THEREOF NIPPON KAYAKU KK (JP) 2004-12-22 EP disclosed
US-6294547-B1 Naphthyridine deratives or salts thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2001-09-25 US disclosed
EP-0997462-A1 NOVEL NAPHTHYRIDINE DERIVATIVES OR SALTS THEREOF Nippon Kayaku Kabushiki Kaisha (JP) 2000-05-03 EP disclosed