SCHEMBL24478453

SCHEMBL24478453

Cc1cc2c(nc1C)n(C1CCN(C(=O)OC(C)(C)C)CC1)c(=O)c(=O)n2C

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 4/20 0.46
MTOR P42345 2/20 0.46
PRKDC P78527 1/20 0.46
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
OPRM1 P35372 2/20 0.42
OPRD1 P41143 2/20 0.42
OGFRL1 Q5TC84 2/20 0.42
GPR119 Q8TDV5 7/20 0.41
TP53 P04637 1/20 0.41
CDK4 P11802 1/20 0.40
CCND1 P24385 1/20 0.40
CCND2 P30279 1/20 0.40
CCND3 P30281 1/20 0.40
HCAR1 Q9BXC0 1/20 0.39
OPRK1 P41145 1/20 0.39
FPR2 P25090 1/20 0.39

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
SCHEMBL24478472 0.90 PIK3CA (0.43) PIK3CAMTORPRKDCKDM4EMAPT
SCHEMBL27101015 0.90 NPBWR1 (0.43) PIK3CAMTORPRKDCKDM4EMAPT
SCHEMBL26879396 0.85 OPRM1 (0.42) PIK3CAMTORPRKDCKDM4EMAPT
SCHEMBL27100950 0.84 PIK3CA (0.47) PIK3CAMTORPRKDCOPRM1OPRD1
SCHEMBL29712748 0.84 PIK3CA (0.47) PIK3CAMTORPRKDCOPRM1OPRD1
SCHEMBL27101052 0.84 PIK3CA (0.48) PIK3CAMTORPRKDCKDM4EMAPT
SCHEMBL30586010 0.84 PIK3CA (0.48) PIK3CAMTORPRKDCKDM4EMAPT
SCHEMBL24478444 0.83 GPR119 (0.44) PIK3CAMTORPRKDCKDM4EMAPT
SCHEMBL24478649 0.82 TP53 (0.46) PIK3CAMTORPRKDCOPRM1OPRD1
SCHEMBL26676845 0.81 GPR119 (0.46) PIK3CAMTORPRKDCOPRM1OPRD1

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
WO-2023229378-A1 HETEROCYCLIC COMPOUND AS DIACYLGLYCEROL KINASE INHIBITOR AND USE THEREOF 주식회사 엘지화학 2023-11-30 WO disclosed
WO-2022114812-A1 HETEROCYCLIC COMPOUND AS DIACYLGLYCEROL KINASE INHIBITOR AND USE THEREOF 주식회사 엘지화학 2022-06-02 WO disclosed