SCHEMBL27100950

SCHEMBL27100950

Cc1ccc2c(n1)n(C1CCN(C(=O)OC(C)(C)C)CC1)c(=O)c(=O)n2C

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 3/20 0.47
MTOR P42345 2/20 0.47
PRKDC P78527 1/20 0.47
GPR119 Q8TDV5 10/20 0.47
OPRM1 P35372 3/20 0.45
OGFRL1 Q5TC84 3/20 0.45
OPRD1 P41143 2/20 0.45
TP53 P04637 1/20 0.44
OPRK1 P41145 2/20 0.41
KMT2A Q03164 1/20 0.41
NPBWR1 P48145 1/20 0.41
MCHR1 Q99705 1/20 0.41

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
SCHEMBL29712748 1.00 PIK3CA (0.47) PIK3CAMTORPRKDCGPR119OPRM1
SCHEMBL24478649 0.89 TP53 (0.46) PIK3CAMTORPRKDCGPR119OPRM1
SCHEMBL27101023 0.88 PIK3CA (0.48) PIK3CAMTORPRKDCGPR119OPRM1
SCHEMBL26676845 0.86 GPR119 (0.46) PIK3CAMTORPRKDCGPR119OPRM1
SCHEMBL26838507 0.85 OPRM1 (0.44) PIK3CAMTORPRKDCGPR119OPRM1
SCHEMBL26671826 0.85 PIK3CA (0.41) PIK3CAMTORPRKDC
SCHEMBL24478453 0.84 PIK3CA (0.46) PIK3CAMTORPRKDCGPR119OPRM1
SCHEMBL24478093 0.84 TP53 (0.41) PIK3CAMTORPRKDCGPR119OPRM1
SCHEMBL26671857 0.83 GPR119 (0.49) PIK3CAMTORPRKDCGPR119OPRM1
SCHEMBL24478472 0.83 PIK3CA (0.43) PIK3CAMTORPRKDCGPR119OPRM1

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
US-20240067645-A1 HETEROCYCLIC COMPOUND AS DIACYLGLYCEROL KINASE INHIBITOR AND USE THEREOF LG CHEM, LTD. (KR) 2024-02-29 US disclosed
CN-116615199-A Heterocyclic compounds as diacylglycerol kinase inhibitors and uses thereof 株式会社LG化学 2023-08-18 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240067645-A1 HETEROCYCLIC COMPOUND AS DIACYLGLYCEROL KINASE INHIBITOR AND USE THEREOF DGKA, DGKB, DGKK PIK3CA 61/4885MTOR 101/4885PRKDC 142/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.