SCHEMBL31179163

SCHEMBL31179163

O=C(O)c1nccc2c1cnn2C1CCCCO1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 1/20 0.47
▸ RXRB P28702 1/20 0.47
▸ RXRG P48443 1/20 0.47
▸ ATR Q13535 14/20 0.43
▸ CYP4F2 P78329 3/20 0.42
▸ CYP4A11 Q02928 3/20 0.42
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ ASPH Q12797 1/20 0.37
▸ KDM8 Q8N371 1/20 0.37

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
SCHEMBL31178607 0.82 CYP4F2 (0.39) RXRARXRBRXRGATRCYP4F2
SCHEMBL30291997 0.81 CYP4F2 (0.42) RXRARXRBRXRGATRCYP4F2
SCHEMBL15666749 0.81 CYP4F2 (0.42) RXRARXRBRXRGATRCYP4F2
SCHEMBL31211538 0.81 RXRA (0.47) RXRARXRBRXRGATRCYP4F2
SCHEMBL31179070 0.79 RXRA (0.47) RXRARXRBRXRGATRCYP4F2
SCHEMBL22499127 0.79 RXRA (0.47) RXRARXRBRXRGATRCYP4F2
SCHEMBL22499128 0.79 RXRA (0.47) RXRARXRBRXRGATRCYP4F2
SCHEMBL22499253 0.78 CYP4F2 (0.40) RXRARXRBRXRGATRCYP4F2
SCHEMBL21986717 0.77 RXRA (0.48) RXRARXRBRXRGATRCYP4F2
SCHEMBL22499021 0.76 ATR (0.52) RXRARXRBRXRGATRCYP4F2

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 RXRA 4502/4885RXRB 4401/4885RXRG 4358/4885

“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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