SCHEMBL30469106

SCHEMBL30469106

CS(=O)(=O)NCc1nn(-c2ccc(C(F)(F)F)cc2)c2ccc(Oc3ccccc3)cc12

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 7/20 0.46
▸ MAPK14 Q16539 2/20 0.41
▸ NPY5R Q15761 1/20 0.41
▸ GRIA2 P42262 1/20 0.39
▸ NR3C1 P04150 1/20 0.38
▸ PGR P06401 1/20 0.38
▸ AR P10275 1/20 0.38
▸ ESR2 Q92731 1/20 0.38
▸ EPHX2 P34913 2/20 0.38
▸ PTGS2 P35354 1/20 0.37
▸ SLC6A2 P23975 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ SLC6A3 Q01959 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ LTA4H P09960 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
SCHEMBL25239918 1.00 SCN9A (0.46) SCN9AMAPK14NPY5RGRIA2NR3C1
SCHEMBL25229655 0.89 AR (0.46) SCN9ANPY5RARPTGS2MEN1
SCHEMBL30469088 0.86 GRIA2 (0.45) SCN9ANPY5RGRIA2EPHX2PTGS2
SCHEMBL25231435 0.86 GRIA2 (0.45) SCN9ANPY5RGRIA2EPHX2PTGS2
SCHEMBL25236495 0.85 SCN9A (0.52) SCN9AMAPK14EPHX2MEN1KMT2A
SCHEMBL30469100 0.84 GRIA2 (0.45) SCN9ANPY5RGRIA2EPHX2
SCHEMBL25281888 0.84 GRIA2 (0.45) SCN9ANPY5RGRIA2EPHX2
SCHEMBL25232751 0.83 SCN9A (0.39) SCN9ANPY5RGRIA2PTGS2SLC6A2
SCHEMBL25234007 0.83 SCN9A (0.39) SCN9ANPY5RGRIA2PTGS2SLC6A2
SCHEMBL30469133 0.83 SCN9A (0.39) SCN9ANPY5RGRIA2PTGS2SLC6A2

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
EP-4452936-A2 INDOLES, INDAZOLES, AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD The Katholieke Universiteit Leuven (BE) 2024-10-30 — — EP disclosed
WO-2023122782-A2 INDOLES, INDAZOLES, AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD THE KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-06-29 — — WO disclosed
US-20230202985-A1 Indoles, Indazoles, and Related Analogs for Inhibiting YAP/TAZ-TEAD CISTIM LEUVEN VZW (BE) 2023-06-29 — — US 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-20230202985-A1 Indoles, Indazoles, and Related Analogs for Inhibiting YAP/TAZ-TEAD YAP1, TEAD2, TEAD3 SCN9A 4442/4885MAPK14 1477/4885NPY5R 2669/4885

“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.

Send feedback