SCHEMBL30532147

SCHEMBL30532147

O=c1[nH]c2cccnc2n1Cc1cncc(F)c1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 16/20 0.50
GRIN2B Q13224 16/20 0.50
DAO P14920 1/20 0.45
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
MAPK10 P53779 1/20 0.43

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
SCHEMBL30532180 0.85 GRIN1 (0.50) GRIN1GRIN2BDAOPKMMAPK10
SCHEMBL17966780 0.83 TP53 (0.53) GRIN1GRIN2BDAOMAPTPKM
SCHEMBL7499251 0.80 KDM4E (0.60) DAO
SCHEMBL30532156 0.75 PTGDR2 (0.49) GRIN1GRIN2BDAO
SCHEMBL29722691 0.72 KDM4E (0.56) DAOMAPT
SCHEMBL23269038 0.72 ATM (0.74) GRIN1GRIN2B
SCHEMBL24312042 0.71 DAO (0.58) DAO
SCHEMBL891521 0.69 DAO (0.55) DAO
SCHEMBL9981108 0.68 DAO (0.58) DAO
SCHEMBL6980977 0.68 PKM (0.79) PKMMAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3523311-B1 SUBSTITUTED 1H-IMIDAZO[4,5-B]PYRIDIN-2(3H)-ONES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2023-06-07 EP disclosed