SCHEMBL31178734

SCHEMBL31178734

O=C(O)c1cccc2c1nnn2C1CCCCO1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 3/20 0.39
▸ HCAR3 P49019 4/20 0.39
▸ RXRA P19793 1/20 0.38
▸ RXRB P28702 1/20 0.38
▸ RXRG P48443 1/20 0.38
▸ CYP4F2 P78329 3/20 0.37
▸ CYP4A11 Q02928 3/20 0.37
▸ FABP4 P15090 2/20 0.34
▸ PDE8B O95263 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ HCRTR1 O43613 1/20 0.33
▸ HCRTR2 O43614 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAP3K5 Q99683 1/20 0.33

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
SCHEMBL10770956 0.83 CYP4F2 (0.38) ATRHCAR3RXRARXRBRXRG
SCHEMBL31178745 0.82 VCP (0.32) ATRRXRARXRBRXRGCYP4F2
SCHEMBL2616547 0.82 HCAR3 (0.53) HCAR3KDM4EUSP2ALDH1A1
SCHEMBL22499128 0.78 RXRA (0.47) ATRRXRARXRBRXRGCYP4F2
SCHEMBL31179070 0.78 RXRA (0.47) ATRRXRARXRBRXRGCYP4F2
SCHEMBL22499127 0.78 RXRA (0.47) ATRRXRARXRBRXRGCYP4F2
SCHEMBL806435 0.74 USP2 (0.49) HCAR3USP2ALDH1A1
SCHEMBL31179188 0.74 HCRTR1 (0.37) ATRCYP4F2CYP4A11HCRTR1HCRTR2
SCHEMBL10770777 0.73 ALDH1A1 (0.39) CYP4F2CYP4A11PDE8BALDH1A1
SCHEMBL10775607 0.73 ALDH1A1 (0.39) CYP4F2CYP4A11PDE8BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260062412-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND HAVING MYT1 INHIBITORY ACTIVITY CHUGAI PHARMACEUTICAL CO LTD (JP) 2026-03-05 — — US disclosed
EP-4647424-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND HAVING MYT1 INHIBITORY ACTIVITY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-11-12 — — EP disclosed
WO-2024181437-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND HAVING MYT1 INHIBITORY ACTIVITY 中外製薬株式会社 2024-09-06 — — 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-20260062412-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND HAVING MYT1 INHIBITORY ACTIVITY MYT1, NTMT1, MYL6 ATR 3688/4885HCAR3 2632/4885RXRA 4502/4885

“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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