SCHEMBL23577113

SCHEMBL23577113

CN(c1cccc2ccccc12)c1nc2nncn2c2cc([N+](=O)[O-])ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 2/20 0.41
▸ ABCG2 Q9UNQ0 2/20 0.39
▸ CYP19A1 P11511 2/20 0.38
▸ MAPT P10636 5/20 0.37
▸ RXFP1 Q9HBX9 2/20 0.37
▸ HRH4 Q9H3N8 1/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ CNR2 P34972 1/20 0.37
▸ APP P05067 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ RECQL P46063 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
SCHEMBL29909617 1.00 SIGMAR1 (0.41) SIGMAR1ABCG2CYP19A1MAPTRXFP1
SCHEMBL23577151 0.85 ABCG2 (0.47) ABCG2CYP19A1MAPTRXFP1HRH4
SCHEMBL30014094 0.85 ABCG2 (0.47) ABCG2CYP19A1MAPTRXFP1HRH4
SCHEMBL29909626 0.85 ABCG2 (0.43) ABCG2CYP19A1MAPTRXFP1HRH4
SCHEMBL23578002 0.85 ABCG2 (0.43) ABCG2CYP19A1MAPTRXFP1HRH4
SCHEMBL23576737 0.82 ABCG2 (0.52) ABCG2CYP19A1MAPTHRH4HRH3
SCHEMBL29909184 0.82 ABCG2 (0.52) ABCG2CYP19A1MAPTHRH4HRH3
SCHEMBL23601765 0.82 ABCG2 (0.44) ABCG2MAPTRXFP1HRH4HRH3
SCHEMBL23578003 0.81 ABCG2 (0.43) ABCG2MAPTRXFP1HRH4HRH3
SCHEMBL24721496 0.81 ABCG2 (0.43) ABCG2MAPTRXFP1HRH4HRH3

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250361236-A9 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS GILEAD SCIENCES INC (US) 2025-11-27 — — US disclosed
US-20240400568-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2024-12-05 — — US disclosed
EP-4445902-A2 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2024-10-16 — — EP disclosed
EP-4081305-B1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS CARNA BIOSCIENCES INC (JP) 2024-09-18 — — EP disclosed
US-12054490-B2 Diacylglycerol kinase modulating compounds GILEAD SCIENCES, INC. (US) 2024-08-06 — — US disclosed
US-20240182476-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2024-06-06 — — US disclosed
US-11845723-B2 Diacylglycerol kinase modulating compounds GILEAD SCIENCES, INC. (US) 2023-12-19 — — US disclosed
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 (6 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-20240400568-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS DGKG, DGKB, DGKK SIGMAR1 3518/4885ABCG2 4216/4885CYP19A1 3959/4885
US-20220324866-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS DGKG, DGKB, DGKK SIGMAR1 3518/4885ABCG2 4216/4885CYP19A1 3959/4885
US-12054490-B2 Diacylglycerol kinase modulating compounds DGKG, DGKB, DGKK SIGMAR1 3518/4885ABCG2 4216/4885CYP19A1 3959/4885
US-11845723-B2 Diacylglycerol kinase modulating compounds DGKG, DGKB, DGKK SIGMAR1 3518/4885ABCG2 4216/4885CYP19A1 3959/4885
US-20240182476-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS DGKG, DGKB, DGKK SIGMAR1 3518/4885ABCG2 4216/4885CYP19A1 3959/4885
US-20250361236-A9 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS DGKG, DGKB, DGKK SIGMAR1 3518/4885ABCG2 4216/4885CYP19A1 3959/4885

“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.

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