SCHEMBL26606996

SCHEMBL26606996

Cc1cc(C(C)(C)C)ccc1-c1cc(=O)c2c(OCCC(C)C)nccc2[nH]1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SCN10A Q9Y5Y9 1/20 0.33
▸ PTGS1 P23219 1/20 0.32
▸ PTGS2 P35354 1/20 0.32
▸ ESR1 P03372 1/20 0.31
▸ EDNRA P25101 1/20 0.31
▸ NR1I2 O75469 1/20 0.30
▸ CYP26A1 O43174 1/20 0.30
▸ CYP26B1 Q9NR63 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
SCHEMBL26607306 0.88 KCNJ5 (0.35) PTGS1PTGS2CYP26A1CYP26B1
SCHEMBL26607006 0.86 KDM4E (0.46) —
SCHEMBL26607211 0.84 KDM5A (0.36) CYP26A1CYP26B1
SCHEMBL26743548 0.81 CYP26A1 (0.35) PTGS1PTGS2CYP26A1CYP26B1
SCHEMBL26607182 0.77 KDM4E (0.35) PTGS1PTGS2CYP26A1CYP26B1
SCHEMBL26725678 0.76 CYP26A1 (0.39) PTGS1PTGS2CYP26A1CYP26B1
SCHEMBL26606889 0.76 KIF11 (0.37) PTGS1PTGS2CYP26A1CYP26B1
SCHEMBL26607146 0.75 CYP26A1 (0.36) SCN10APTGS1PTGS2CYP26A1CYP26B1
SCHEMBL26607293 0.75 CYP26A1 (0.34) SCN10APTGS1PTGS2CYP26A1CYP26B1
SCHEMBL26724147 0.69 CYP26A1 (0.39) CYP26A1CYP26B1

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-4511114-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN Vertex Pharmaceuticals Incorporated (US) 2025-02-26 — — EP disclosed
US-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED 2023-11-30 — — US disclosed
US-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED 2023-11-30 — — US disclosed
US-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED 2023-11-30 — — US disclosed
WO-2023205778-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-10-26 — — WO disclosed
WO-2023205778-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-10-26 — — 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-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN TRPV1, SCN3A, KCNN3 SCN10A 10/4885PTGS1 340/4885PTGS2 308/4885

“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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