SCHEMBL7697805

SCHEMBL7697805

O=C(NCc1ccc(Cl)cc1)c1nc(-c2ccccc2)oc1-c1ccncc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.50
CCNE1 P24864 1/20 0.50
CDK2 P24941 1/20 0.50
DBF4 Q9UBU7 1/20 0.50
POLB P06746 1/20 0.48
GSK3B P49841 2/20 0.48
ROCK2 O75116 2/20 0.48
ROCK1 Q13464 2/20 0.48
RPS6KA5 O75582 1/20 0.48
MAP4K4 O95819 1/20 0.48
PRKCG P05129 1/20 0.48
PRKACA P17612 1/20 0.48
RPS6KB1 P23443 1/20 0.48
MAPK1 P28482 1/20 0.48
AKT1 P31749 1/20 0.48
GSK3A P49840 1/20 0.48
PRKX P51817 1/20 0.48
PRKCD Q05655 1/20 0.48
PRKG2 Q13237 1/20 0.48
DYRK1A Q13627 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
SCHEMBL7700027 0.78 SMN1; SMN2 (0.50) POLBCYP1A2CYP2C9HPGDCYP2C19
SCHEMBL7700999 0.78 MAPT (0.48) CDC7CCNE1CDK2DBF4POLB
SCHEMBL7705421 0.78 CNR1 (0.50) GSK3BROCK2PRKCGPRKCD
SCHEMBL30106340 0.77 CDC25A (0.47) POLBMAPK1HPGDNPSR1TP53
SCHEMBL7693805 0.77 KDM4E (0.58) POLBGSK3BROCK2ROCK1HPGD
SCHEMBL7701209 0.75 NPC1 (0.51) CDC7DBF4POLBMAPK1TSHR
SCHEMBL7697807 0.74 GPBAR1 (0.47) POLBMAPK1CYP1A2CYP2C9HPGD
SCHEMBL11623795 0.73 GAA (0.60) POLBMAPK1TSHRTHRBKDM4E
SCHEMBL29158752 0.73 BCL2L1 (0.52) ABCB1TSHRHPGDTP53ALDH1A1
SCHEMBL6370461 0.72 ERAP1 (0.47) CDK2

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
WO-2002064558-A2 OXAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS CYTOKINE INHIBITORS SANKYO COMPANY, LIMITED (JP) 2002-08-22 WO disclosed