SCHEMBL24631163

SCHEMBL24631163

CNS(=O)(=O)c1ccc(Oc2ccc(C(F)(F)F)cc2)c(-c2ccc3c(c2)CC(=O)N3)c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 3/20 0.45
▸ GAA P10253 2/20 0.44
▸ ALOX5AP P20292 1/20 0.42
▸ FEN1 P39748 1/20 0.42
▸ TDP2 O95551 1/20 0.42
▸ BRD4 O60885 1/20 0.42
▸ PKM P14618 4/20 0.41
▸ PKLR P30613 1/20 0.41
▸ SCN9A Q15858 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ GRIA1 P42261 1/20 0.40
▸ CACNG8 Q8WXS5 1/20 0.40
▸ MET P08581 1/20 0.39
▸ MOGAT2 Q3SYC2 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ AKT1 P31749 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
SCHEMBL30868613 1.00 KIF11 (0.45) KIF11GAAALOX5APFEN1TDP2
SCHEMBL30868583 0.85 LMNA (0.42) KIF11BRD4PKMALDH1A1MOGAT2
SCHEMBL24631405 0.85 LMNA (0.42) KIF11BRD4PKMALDH1A1MOGAT2
SCHEMBL30868578 0.83 LMNA (0.48) PKMALDH1A1
SCHEMBL24631313 0.83 LMNA (0.48) PKMALDH1A1
SCHEMBL24631171 0.79 BRAF (0.45) BRD4PKMSCN9A
SCHEMBL30868535 0.79 BRAF (0.45) BRD4PKMSCN9A
SCHEMBL24631240 0.77 MAPT (0.44) BRD4PKMALDH1A1
SCHEMBL30868516 0.77 TRIM24 (0.45) BRD4PKMALDH1A1
SCHEMBL27170920 0.77 TRIM24 (0.45) BRD4PKMALDH1A1

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 2 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 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 KIF11 2051/4885GAA 1282/4885ALOX5AP 1957/4885

“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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