SCHEMBL30042357

SCHEMBL30042357

O=c1[nH]c2nc(Cl)ccc2c(=O)o1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
ADORA2A P29274 2/20 0.45
ADORA1 P30542 2/20 0.45
GMNN O75496 1/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
PKM P14618 1/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
MTOR P42345 1/20 0.45
BLM P54132 1/20 0.45
PMP22 Q01453 1/20 0.45
HIF1A Q16665 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 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
SCHEMBL6921298 0.80 ADORA2A (0.44) KDM4EADORA2AADORA1F2CFD
SCHEMBL1266435 0.79 ADORA1 (0.50) KDM4EADORA2AADORA1F2CFD
SCHEMBL13853278 0.75 ELANE (0.41) KDM4EF2CFDC1RALDH1A1
SCHEMBL31163568 0.71 NOS1 (0.42) KDM4ELMNACYP1A2TSHRBLM
SCHEMBL1218582 0.70 GRIN2D (0.49) KDM4EADORA2AADORA1GMNNLMNA
SCHEMBL30980985 0.70 GRIN2D (0.49) KDM4EADORA2AADORA1GMNNLMNA
SCHEMBL1522777 0.69 PARP1 (0.53) ADORA2AADORA1HSD17B10F2CFD
SCHEMBL18306004 0.68 ADORA2A (0.65) KDM4EADORA2AADORA1GMNNLMNA
SCHEMBL5369123 0.68 KDM4E (0.50) KDM4EADORA2AADORA1GMNNLMNA
SCHEMBL5368416 0.67 LMNA (0.53) KDM4EADORA2AADORA1GMNNLMNA

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
CN-108069957-B Prolyl hydroxylase inhibitors and uses thereof 广东东阳光药业有限公司 2022-11-04 CN disclosed