SCHEMBL26065201

SCHEMBL26065201

Cc1nc(C(F)(F)F)ccc1S(=O)(=O)N1CCN(C(=O)C23CCOC(C)(C2)C3)CC1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.38
▸ TRPV4 Q9HBA0 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ HSD11B1 P28845 1/20 0.33
▸ PKM P14618 2/20 0.33
▸ LMNA P02545 1/20 0.33

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
SCHEMBL26065190 0.91 KMT2A (0.39) KMT2ATRPV4ALDH1A1MEN1KDM4E
SCHEMBL27346590 0.90 TRPV4 (0.39) KMT2ATRPV4LMNA
SCHEMBL30719552 0.90 TRPV4 (0.39) KMT2ATRPV4LMNA
SCHEMBL30719563 0.90 TRPV4 (0.39) KMT2ATRPV4LMNA
SCHEMBL25370116 0.89 TRPV4 (0.37) KMT2ATRPV4
SCHEMBL30567075 0.89 TRPV4 (0.37) KMT2ATRPV4
SCHEMBL30719527 0.80 TRPV4 (0.40) KMT2ATRPV4LMNA
SCHEMBL27346613 0.80 TRPV4 (0.40) KMT2ATRPV4LMNA
SCHEMBL26065199 0.80 TRPV4 (0.37) KMT2ATRPV4ALDH1A1MEN1KDM4E
SCHEMBL25369209 0.80 TRPV4 (0.38) KMT2ATRPV4

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-2023164063-A1 EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF BIOGEN MA INC. (US) 2023-08-31 — — WO disclosed
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