SCHEMBL24465321

SCHEMBL24465321

CCC1(c2ccc(C(=O)NS(=O)(=O)C(F)(F)F)cc2)CO1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.39
SCN9A Q15858 1/20 0.39
CCR2 P41597 1/20 0.38
VCP P55072 1/20 0.38
TSHR P16473 1/20 0.35
HTR7 P34969 1/20 0.35
WDR91 A4D1P6 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
EPHX2 P34913 2/20 0.33
HDAC8 Q9BY41 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
PTPN1 P18031 1/20 0.33
MLYCD O95822 1/20 0.33
MGAT2 Q10469 1/20 0.33
CTSL P07711 1/20 0.33
CTSS P25774 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
SCHEMBL24465322 0.85 SCN5A (0.36) SCN5ASCN9ACCR2VCPHTR7
SCHEMBL14416780 0.75 PLK1 (0.54) SCN5ASCN9AVCPSMN1; SMN2PPARG
SCHEMBL22503102 0.73 SCN5A (0.45) SCN5ASCN9AVCPHTR7MAPK1
SCHEMBL22503064 0.73 SCN9A (0.45) SCN5ASCN9AVCPHTR7MAPK1
SCHEMBL20364782 0.73 HDAC8 (0.45) SCN5ASCN9AVCPTSHRSMN1; SMN2
SCHEMBL22503309 0.73 HDAC1 (0.55) SCN5ASCN9AVCPSMN1; SMN2MEN1
SCHEMBL22503088 0.72 PLK1 (0.57) SCN5ASCN9AVCPKMT2APPARG
SCHEMBL22503319 0.72 LMNA (0.49) SCN5ASCN9AVCPSMN1; SMN2MEN1
SCHEMBL22503081 0.71 PPARD (0.49) SCN5ASCN9AVCPSMN1; SMN2MEN1
SCHEMBL22503094 0.71 MAPT (0.49) SCN5ASCN9ATSHRMEN1KMT2A

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
EP-4006921-A2 BIO-ELECTRODE COMPOSITION, BIO-ELECTRODE, METHOD FOR MANUFACTURING BIO-ELECTRODE, AND REACTION COMPOSITE Shin-Etsu Chemical Co., Ltd. (JP) 2022-06-01 EP disclosed