SCHEMBL30310137

SCHEMBL30310137

C#C[C@@](C)(O)c1ccncn1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.45
▸ CYP3A4 P08684 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.30
▸ P2RX7 Q99572 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30

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
SCHEMBL26102426 1.00 CYP19A1 (0.45) CYP19A1CYP3A4HSP90AA1HDAC8P2RX7
SCHEMBL11970656 1.00 CYP19A1 (0.45) CYP19A1CYP3A4HSP90AA1HDAC8P2RX7
SCHEMBL26105611 0.81 CYP19A1 (0.45) CYP19A1CYP3A4HSP90AA1P2RX7KDM4E
SCHEMBL16091462 0.78 CYP19A1 (0.52) CYP19A1CYP3A4HSP90AA1P2RX7KDM4E
SCHEMBL11970541 0.77 CYP19A1 (0.41) CYP19A1CYP3A4HSP90AA1
SCHEMBL29439780 0.76 SMN1; SMN2 (0.55) CYP3A4KDM4E
SCHEMBL15192459 0.76 SMN1; SMN2 (0.55) CYP3A4KDM4E
SCHEMBL29472057 0.76 SMN1; SMN2 (0.55) CYP3A4KDM4E
SCHEMBL15193140 0.76 SMN1; SMN2 (0.55) CYP3A4KDM4E
SCHEMBL1613102 0.76 SMN1; SMN2 (0.55) CYP3A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4423075-B1 CCR6 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2026-03-25 — — EP disclosed
US-20250011313-A1 CCR6 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2025-01-09 — — US disclosed
EP-4423075-A1 CCR6 RECEPTOR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2024-09-04 — — EP disclosed
CN-118139854-A Modulators of CCR6 receptors 爱杜西亚药品有限公司 2024-06-04 — — CN disclosed
WO-2023073082-A1 CCR6 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2023-05-04 — — 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-20250011313-A1 CCR6 RECEPTOR MODULATORS CCR6, CCR1, CCR4 CYP19A1 3211/4885CYP3A4 2304/4885HSP90AA1 2644/4885

“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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