SCHEMBL31001763

SCHEMBL31001763

CC(O)c1ccn2ncc(F)c2n1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SMPD3 Q9NY59 5/20 0.36
▸ IRAK4 Q9NWZ3 4/20 0.35
▸ TGFBR1 P36897 1/20 0.33
▸ TGFBR2 P37173 1/20 0.33
▸ NTRK1 P04629 9/20 0.33
▸ NTRK3 Q16288 3/20 0.33
▸ NTRK2 Q16620 3/20 0.33
▸ TYK2 P29597 1/20 0.33
▸ JAK2 O60674 2/20 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
SCHEMBL17132579 0.87 SMPD3 (0.38) SMPD3IRAK4NTRK1NTRK3NTRK2
SCHEMBL31003111 0.82 SCN5A (0.42) SMPD3IRAK4TYK2JAK2
SCHEMBL31001778 0.74 TGFBR1 (0.31) TGFBR1TGFBR2
SCHEMBL15715204 0.74 TYK2 (0.47) SMPD3TGFBR1TYK2
SCHEMBL31003081 0.73 TGFBR1 (0.31) TGFBR1TGFBR2
SCHEMBL31001747 0.73 TGFBR1 (0.31) TGFBR1TGFBR2
SCHEMBL31001911 0.72 TGFBR1 (0.30) TGFBR1TGFBR2
SCHEMBL13975698 0.71 SMPD3 (0.37) SMPD3
SCHEMBL31001791 0.71 TYK2 (0.38) SMPD3IRAK4TGFBR1NTRK1NTRK3
SCHEMBL26141124 0.71 SMPD3 (0.34) SMPD3NTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4658655-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITOR OF DIACYLGLYCEROL KINASES Beone Medicines I GmbH (CH) 2025-12-10 — — EP disclosed
EP-4658656-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITOR OF DIACYLGLYCEROL KINASES Beone Medicines I GmbH (CH) 2025-12-10 — — EP disclosed
US-20250353858-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITOR OF DIACYLGLYCEROL KINASES BEONE MEDICINES I GMBH (CH) 2025-11-20 — — US disclosed
US-20250346597-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITOR OF DIACYLGLYCEROL KINASES BEONE MEDICINES I GMBH (CH) 2025-11-13 — — US disclosed
WO-2024160278-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITOR OF DIACYLGLYCEROL KINASES BEIGENE, LTD. (KY) 2024-08-08 — — WO disclosed
WO-2024160276-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITOR OF DIACYLGLYCEROL KINASES BEIGENE, LTD. (KY) 2024-08-08 — — 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 (2 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-20250353858-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITOR OF DIACYLGLYCEROL KINASES DGKG, DGKK, DGKA SMPD3 374/4885IRAK4 845/4885TGFBR1 4123/4885
US-20250346597-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS INHIBITOR OF DIACYLGLYCEROL KINASES DGKG, DGKA, DGKK SMPD3 663/4885IRAK4 1084/4885TGFBR1 4145/4885

“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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