SCHEMBL23601022

SCHEMBL23601022

CN(c1cccc(-c2ccc(C(F)(F)F)cc2F)c1)c1nc2nncn2c2cc(Cl)c(F)cc12

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.37
GRM2 Q14416 1/20 0.34
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
P2RX7 Q99572 1/20 0.33
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
ABCG2 Q9UNQ0 1/20 0.32
MAT2A P31153 1/20 0.31
EGFR P00533 2/20 0.31
CSF1R P07333 2/20 0.31
AKR1C3 P42330 1/20 0.31
AKR1C2 P52895 1/20 0.31

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
SCHEMBL30960977 1.00 HSD11B1 (0.37) HSD11B1GRM2FNTAFNTBP2RX7
SCHEMBL23601029 0.91 FNTA (0.34) FNTAFNTBP2RX7ABCG2MAT2A
SCHEMBL23577166 0.85 FNTA (0.34) FNTAFNTBABCG2
SCHEMBL29909794 0.85 FNTA (0.34) FNTAFNTBABCG2
SCHEMBL23601666 0.83 ABCG2 (0.35) FNTAFNTBABCG2EGFRCSF1R
SCHEMBL23577385 0.82 ABCG2 (0.34) ABCG2
SCHEMBL23577460 0.82 NT5E (0.34) FNTAFNTBABCG2
SCHEMBL23577999 0.82 ABCG2 (0.42) ABCG2
SCHEMBL29909434 0.82 ABCG2 (0.42) ABCG2
SCHEMBL23601242 0.81 MAPT (0.41) ABCG2EGFRCSF1R

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-20220324866-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2022-10-13 US disclosed
WO-2021130638-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS CARNA BIOSCIENCES, INC. (JP) 2021-07-01 WO 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-20220324866-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS DGKG, DGKB, DGKK HSD11B1 2545/4885GRM2 1977/4885FNTA 968/4885

“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.