SCHEMBL24631283

SCHEMBL24631283

CNS(=O)(=O)c1ccc(Oc2ccc(C(F)(F)F)cc2)c(-c2nc3cc(OC)ccc3[nH]2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 2/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ BRAF P15056 4/20 0.39
▸ TNNI3K Q59H18 4/20 0.39
▸ MAPT P10636 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ BRD4 O60885 2/20 0.38
▸ TEAD1 P28347 1/20 0.37
▸ YAP1 P46937 1/20 0.37
▸ AMY1A P0DUB6 1/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ CHEK2 O96017 1/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ PLAU P00749 1/20 0.36
▸ PLAT P00750 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36

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
SCHEMBL30868617 1.00 NR1I2 (0.42) NR1I2MEN1ALOX15MAPK1KMT2A
SCHEMBL24631171 0.77 BRAF (0.45) MEN1ALOX15MAPK1KMT2ABRAF
SCHEMBL30868535 0.77 BRAF (0.45) MEN1ALOX15MAPK1KMT2ABRAF
SCHEMBL30868587 0.77 MEN1 (0.43) MEN1ALOX15MAPK1KMT2ABRAF
SCHEMBL24631316 0.77 MEN1 (0.43) MEN1ALOX15MAPK1KMT2ABRAF
SCHEMBL24631169 0.76 MEN1 (0.41) MEN1ALOX15MAPK1KMT2ABRD4
SCHEMBL30868606 0.74 SCN9A (0.41) MEN1ALOX15MAPK1KMT2ABRAF
SCHEMBL24631406 0.74 SCN9A (0.41) MEN1ALOX15MAPK1KMT2ABRAF
SCHEMBL24631116 0.74 MEN1 (0.39) MEN1ALOX15MAPK1KMT2ABRAF
SCHEMBL30868560 0.74 BRAF (0.38) MEN1ALOX15MAPK1KMT2ABRAF

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 NR1I2 70/4885MEN1 4234/4885ALOX15 1578/4885

“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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