SCHEMBL26065216

SCHEMBL26065216

Cc1nc(C(F)(F)F)ccc1S(=O)(=O)N1CCN(C2(C#N)CCOCC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.38
▸ CASP3 P42574 2/20 0.36
▸ ABL1 P00519 2/20 0.35
▸ BCR P11274 2/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ GAA P10253 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ BRS3 P32247 1/20 0.34
▸ CNR1 P21554 2/20 0.33
▸ CNR2 P34972 2/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ ABCC9 O60706 1/20 0.33
▸ ABCC8 Q09428 1/20 0.33
▸ KCNJ11 Q14654 1/20 0.33
▸ KCNJ8 Q15842 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
SCHEMBL25370900 0.88 TRPV4 (0.42) TRPV4KDM4ECASP3SMN1; SMN2KMT2A
SCHEMBL26065214 0.86 KDM4E (0.41) TRPV4KDM4ECASP3ABL1BCR
SCHEMBL26066057 0.79 KCNH2 (0.43) TRPV4KDM4ECASP3ALDH1A1GAA
SCHEMBL26065732 0.79 TRPV4 (0.39) TRPV4KDM4ECASP3ALDH1A1GAA
SCHEMBL26065205 0.78 SMN1; SMN2 (0.43) TRPV4KDM4ECASP3ALDH1A1GAA
SCHEMBL26065760 0.78 CNR1 (0.37) TRPV4KDM4ECASP3ABL1BCR
SCHEMBL26065210 0.77 CTSK (0.44) KDM4EABL1BCRALDH1A1GAA
SCHEMBL26064898 0.76 MEN1 (0.43) TRPV4KDM4EALDH1A1GAASMN1; SMN2
SCHEMBL25370147 0.76 TRPV4 (0.41) TRPV4KDM4ECASP3SMN1; SMN2BRS3
SCHEMBL25363280 0.74 SMN1; SMN2 (0.39) TRPV4KDM4ECASP3ALDH1A1SMN1; SMN2

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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