SCHEMBL26607293

SCHEMBL26607293

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

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CYP26A1 O43174 1/20 0.34
▸ CYP26B1 Q9NR63 1/20 0.34
▸ PTGS1 P23219 1/20 0.32
▸ PTGS2 P35354 1/20 0.32
▸ KDM5A P29375 1/20 0.31
▸ KDM4C Q9H3R0 1/20 0.31
▸ KDM5B Q9UGL1 1/20 0.31
▸ PIK3C3 Q8NEB9 1/20 0.31
▸ SCN10A Q9Y5Y9 3/20 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
SCHEMBL26607146 0.91 CYP26A1 (0.36) CYP26A1CYP26B1PTGS1PTGS2KDM5A
SCHEMBL26725678 0.88 CYP26A1 (0.39) CYP26A1CYP26B1PTGS1PTGS2KDM5A
SCHEMBL26606889 0.85 KIF11 (0.37) CYP26A1CYP26B1PTGS1PTGS2KDM5A
SCHEMBL26743548 0.84 CYP26A1 (0.35) CYP26A1CYP26B1PTGS1PTGS2KDM5A
SCHEMBL26725879 0.84 CYP26A1 (0.44) CYP26A1CYP26B1PTGS1PTGS2SCN10A
SCHEMBL26725991 0.81 JAK2 (0.35) KDM5AKDM4CKDM5B
SCHEMBL26607211 0.81 KDM5A (0.36) CYP26A1CYP26B1KDM5AKDM4CKDM5B
SCHEMBL26725996 0.81 CYP2C19 (0.36) CYP26A1CYP26B1PTGS1PTGS2PIK3C3
SCHEMBL26726116 0.81 ALOX5AP (0.37) PTGS1PTGS2SCN10A
SCHEMBL26607182 0.80 KDM4E (0.35) CYP26A1CYP26B1PTGS1PTGS2PIK3C3

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 CYP26A1 1396/4885CYP26B1 1499/4885PTGS1 340/4885

“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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