SCHEMBL26498086

SCHEMBL26498086

C/C=C/C(F)(F)c1ccc(C(=O)c2ccn(C3CCN(C(=O)OC(C)(C)C)CC3)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 3/20 0.40
▸ KMT2A Q03164 1/20 0.39
▸ GPR119 Q8TDV5 13/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.38
▸ NR3C1 P04150 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ PKM P14618 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
SCHEMBL26133844 0.89 GPR119 (0.48) HDAC4KMT2AGPR119HDAC6NR3C1
SCHEMBL26498098 0.77 TEAD1 (0.42) —
SCHEMBL20046185 0.77 GPR119 (0.49) KMT2AGPR119KDM4EPKM
SCHEMBL29098488 0.77 GPR119 (0.46) GPR119
SCHEMBL2586290 0.75 GPR119 (0.48) KMT2AGPR119KDM4EPKM
SCHEMBL26134135 0.75 TEAD1 (0.49) —
SCHEMBL14637172 0.74 STS (0.46) HDAC4GPR119
SCHEMBL27459322 0.73 GPR119 (0.47) HDAC4KMT2AGPR119
SCHEMBL14635882 0.72 GPR119 (0.48) KMT2AGPR119KDM4EPKM
SCHEMBL15950964 0.72 GPR119 (0.50) KMT2AGPR119

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
WO-2023183768-A2 SMALL MOLECULE INHIBITORS OF TEA DOMAIN FAMILY MEMBERS THE SCRIPPS RESEARCH INSTITUTE (US) 2023-09-28 — — WO disclosed
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