SCHEMBL29237459

SCHEMBL29237459

Cc1c(Oc2ccc(F)c(C(=N)N)c2)c(F)cc2[nH]ccc12

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.34
▸ DRD1 P21728 1/20 0.33
▸ F10 P00742 4/20 0.33
▸ RHEB Q15382 2/20 0.33
▸ F2 P00734 2/20 0.32
▸ PRKAB2 O43741 1/20 0.30
▸ PRKAG1 P54619 1/20 0.30
▸ PRKAA2 P54646 1/20 0.30
▸ PRKAA1 Q13131 1/20 0.30
▸ PRKAG3 Q9UGI9 1/20 0.30
▸ PRKAG2 Q9UGJ0 1/20 0.30
▸ PRKAB1 Q9Y478 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
SCHEMBL30217071 1.00 TRPA1 (0.34) TRPA1DRD1F10RHEBF2
SCHEMBL30967808 0.88 TRPA1 (0.34) TRPA1DRD1RHEBPRKAB2PRKAG1
SCHEMBL29237596 0.88 TRPA1 (0.34) TRPA1DRD1RHEBPRKAB2PRKAG1
SCHEMBL27382327 0.88 TRPA1 (0.36) TRPA1DRD1F10RHEBF2
SCHEMBL27265231 0.86 TRPA1 (0.34) TRPA1RHEBF2
SCHEMBL30217023 0.85 TRPA1 (0.33) TRPA1DRD1RHEB
SCHEMBL29237313 0.85 TRPA1 (0.33) TRPA1DRD1RHEB
SCHEMBL31108627 0.84 TRPA1 (0.33) TRPA1RHEB
SCHEMBL30217304 0.84 TRPA1 (0.33) TRPA1RHEB
SCHEMBL27265135 0.84 TRPA1 (0.33) TRPA1RHEB

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-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE GENZYME CORPORATION 2024-07-18 — — US disclosed
US-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE GENZYME CORPORATION 2024-07-18 — — US disclosed
CN-118201919-A Indole compounds and methods of use 健赞公司 2024-06-14 — — CN 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-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE CFTR, INMT, IDO1 TRPA1 66/4885DRD1 1043/4885F10 3750/4885

“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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