SCHEMBL29909033

SCHEMBL29909033

CN(c1cccc(-c2ccc(S(=O)(=O)CC3CC3)cc2)c1)c1nc2nnc(Cl)n2c2ccccc12

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.33
GLP1R P43220 1/20 0.33
CNR2 P34972 5/20 0.32
CNR1 P21554 2/20 0.32
CYP1A2 P05177 3/20 0.32
CYP3A4 P08684 3/20 0.32
CYP2C9 P11712 3/20 0.32
CYP2C19 P33261 3/20 0.32
DHODH Q02127 1/20 0.31
CYP2D6 P10635 1/20 0.31
NMT1 P30419 1/20 0.31
PDE5A O76074 2/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2B Q13224 1/20 0.30

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
SCHEMBL29909330 0.91 CYP1A2 (0.38) ABCG2CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL30961045 0.88 KCNH2 (0.34) ABCG2CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL29909683 0.87 RORC (0.34) ABCG2CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL29909415 0.87 RORC (0.37) ABCG2DHODHPDE5A
SCHEMBL29909021 0.84 ABCG2 (0.34) ABCG2DHODHPDE5A
SCHEMBL29909607 0.84 ABCG2 (0.34) ABCG2DHODHPDE5A
SCHEMBL29909178 0.84 ABCG2 (0.33) ABCG2CYP2C9DHODHPDE5A
SCHEMBL29909227 0.83 ABCG2 (0.34) ABCG2DHODHPDE5A
SCHEMBL29909583 0.83 TSHR (0.45) PDE5A
SCHEMBL23601393 0.81 MAT2A (0.34) GLP1RCNR2CYP1A2

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-12054490-B2 Diacylglycerol kinase modulating compounds GILEAD SCIENCES, INC. (US) 2024-08-06 US disclosed
EP-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 EP 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-12054490-B2 Diacylglycerol kinase modulating compounds DGKG, DGKB, DGKK ABCG2 4216/4885GLP1R 2631/4885CNR2 1348/4885

“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.