SCHEMBL26066052

SCHEMBL26066052

Cc1nc(C(F)(F)F)ccc1S(=O)(=O)N1CCN(CCC2CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 12/20 0.44
▸ HTR7 P34969 12/20 0.44
▸ HTR6 P50406 12/20 0.44
▸ HTR1A P08908 11/20 0.44
▸ HTR2A P28223 11/20 0.44
▸ DRD3 P35462 2/20 0.43
▸ TRPV4 Q9HBA0 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ DRD4 P21917 1/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ HTR2B P41595 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CYP3A4 P08684 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39

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
SCHEMBL25371215 0.86 TRPV4 (0.43) DRD2HTR7HTR6HTR1AHTR2A
SCHEMBL30567053 0.86 TRPV4 (0.43) DRD2HTR7HTR6HTR1AHTR2A
SCHEMBL26065980 0.84 POLB (0.54) TRPV4MEN1KMT2AALDH1A1MAPT
SCHEMBL26066053 0.83 L3MBTL1 (0.45) TRPV4MEN1KMT2AALDH1A1MAPT
SCHEMBL26065891 0.83 TRPV4 (0.41) TRPV4MEN1KMT2AALDH1A1MAPT
SCHEMBL26065889 0.83 EBP (0.44) TRPV4
SCHEMBL26065919 0.81 EBP (0.39) TRPV4MEN1KMT2AALDH1A1MAPT
SCHEMBL26065982 0.81 L3MBTL1 (0.39) DRD2DRD3TRPV4MEN1KMT2A
SCHEMBL26065920 0.81 EBP (0.39) TRPV4MEN1KMT2AALDH1A1MAPT
SCHEMBL26065762 0.81 EBP (0.39) TRPV4MEN1KMT2AALDH1A1MAPT

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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