SCHEMBL29909415

SCHEMBL29909415

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

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.37
LRRK2 Q5S007 1/20 0.36
ABCG2 Q9UNQ0 2/20 0.36
SCD O00767 1/20 0.36
PTGS2 P35354 6/20 0.36
PTGS1 P23219 1/20 0.36
TP53 P04637 1/20 0.35
DHODH Q02127 1/20 0.34
PDE5A O76074 1/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34

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) RORCABCG2DHODH
SCHEMBL29909021 0.90 ABCG2 (0.34) RORCABCG2DHODHPDE5ANR1H2
SCHEMBL29909607 0.89 ABCG2 (0.34) ABCG2PTGS2PTGS1DHODHPDE5A
SCHEMBL29909909 0.89 DHODH (0.41) RORCABCG2SCDPTGS2PTGS1
SCHEMBL29909927 0.89 RORC (0.38) RORCSCDPTGS2PTGS1TP53
SCHEMBL29909178 0.89 ABCG2 (0.33) ABCG2PTGS2DHODHPDE5A
SCHEMBL30961045 0.88 KCNH2 (0.34) ABCG2DHODHPDE5A
SCHEMBL29909623 0.88 PTGDR2 (0.35) ABCG2PTGS2PTGS1
SCHEMBL30961011 0.88 NR1H2 (0.37) RORCLRRK2SCDPTGS2PTGS1
SCHEMBL29909683 0.88 RORC (0.34) RORCABCG2DHODHPDE5A

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 RORC 1542/4885LRRK2 832/4885ABCG2 4216/4885

“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.