SCHEMBL24631191

SCHEMBL24631191

CNc1ncc2cc(-c3cc(S(=O)(=O)NC)ccc3Oc3ccc(C(F)(F)F)cc3)ccc2n1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 14/20 0.45
▸ KDR P35968 12/20 0.45
▸ MAPK14 Q16539 12/20 0.45
▸ JAK3 P52333 10/20 0.45
▸ BRAF P15056 3/20 0.43
▸ TEK Q02763 1/20 0.43
▸ SRC P12931 1/20 0.42
▸ TYK2 P29597 1/20 0.42
▸ SYK P43405 1/20 0.42
▸ BTK Q06187 1/20 0.42
▸ TEAD1 P28347 1/20 0.39
▸ YAP1 P46937 1/20 0.39
▸ EIF2AK3 Q9NZJ5 1/20 0.38
▸ EIF2AK4 Q9P2K8 1/20 0.38
▸ SCN9A Q15858 2/20 0.38

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
SCHEMBL30868579 1.00 LCK (0.45) LCKKDRMAPK14JAK3BRAF
SCHEMBL24631203 0.84 BRD4 (0.39) TEAD1YAP1SCN9A
SCHEMBL30868590 0.84 BRD4 (0.39) TEAD1YAP1SCN9A
SCHEMBL30868598 0.83 TEAD1 (0.42) TEAD1YAP1SCN9A
SCHEMBL24631413 0.83 TEAD1 (0.42) TEAD1YAP1SCN9A
SCHEMBL24631406 0.83 SCN9A (0.41) BRAFTEAD1YAP1SCN9A
SCHEMBL30868606 0.83 SCN9A (0.41) BRAFTEAD1YAP1SCN9A
SCHEMBL24631201 0.80 TRPV1 (0.46) TEAD1YAP1SCN9A
SCHEMBL30868586 0.80 ALOX5AP (0.42) TEAD1YAP1SCN9A
SCHEMBL30868602 0.80 TRPV1 (0.46) TEAD1YAP1SCN9A

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-20240083903-A1 ARYL ETHER COMPOUNDS AS TEAD MODULATORS MERCK SHARP & DOHME LLC (US) 2024-03-14 — — US claimed
US-20240083903-A1 ARYL ETHER COMPOUNDS AS TEAD MODULATORS MERCK SHARP & DOHME LLC (US) 2024-03-14 — — US disclosed
WO-2022177869-A1 ARYL ETHER COMPOUNDS AS TEAD MODULATORS MERCK SHARP & DOHME LLC (US) 2022-08-25 — — 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-20240083903-A1 ARYL ETHER COMPOUNDS AS TEAD MODULATORS TEAD2, TEAD3, TEAD4 LCK 682/4885KDR 3560/4885MAPK14 1048/4885

“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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