SCHEMBL30868587

SCHEMBL30868587

CNS(=O)(=O)c1ccc(Oc2ccc(C(F)(F)F)cc2)c(-c2cc3ccc(C)nc3cc2OC)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SCN9A Q15858 11/20 0.41
▸ BRAF P15056 3/20 0.40
▸ TNNI3K Q59H18 3/20 0.40
▸ RAF1 P04049 2/20 0.39
▸ BRD4 O60885 1/20 0.39
▸ TEAD1 P28347 1/20 0.38
▸ YAP1 P46937 1/20 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
SCHEMBL24631316 1.00 MEN1 (0.43) MEN1ALOX15MAPK1KMT2ASCN9A
SCHEMBL24631203 0.86 BRD4 (0.39) MEN1ALOX15MAPK1KMT2ASCN9A
SCHEMBL30868590 0.86 BRD4 (0.39) MEN1ALOX15MAPK1KMT2ASCN9A
SCHEMBL30868606 0.81 SCN9A (0.41) MEN1ALOX15MAPK1KMT2ASCN9A
SCHEMBL24631406 0.81 SCN9A (0.41) MEN1ALOX15MAPK1KMT2ASCN9A
SCHEMBL24631116 0.80 MEN1 (0.39) MEN1ALOX15MAPK1KMT2ASCN9A
SCHEMBL29814319 0.80 MEN1 (0.39) MEN1ALOX15MAPK1KMT2ASCN9A
SCHEMBL24631169 0.78 MEN1 (0.41) MEN1ALOX15MAPK1KMT2ASCN9A
SCHEMBL24631283 0.77 NR1I2 (0.42) MEN1ALOX15MAPK1KMT2ABRAF
SCHEMBL30868617 0.77 NR1I2 (0.42) 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 1 patent. 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 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 MEN1 4234/4885ALOX15 1578/4885MAPK1 1232/4885

“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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