SCHEMBL20360484

SCHEMBL20360484

CCC=CCC(=Cc1ccccc1)S(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NR1I2 O75469 1/20 0.37
AKR1C3 P42330 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
LMNA P02545 1/20 0.36
PAM P19021 1/20 0.36
RECQL P46063 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
PPARG P37231 1/20 0.35
FBP1 P09467 1/20 0.34
PTGS2 P35354 1/20 0.34
NR1H4 Q96RI1 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
SCHEMBL913491 0.81 MEN1 (0.44) MEN1KMT2ANR1I2AKR1C3ALDH1A1
SCHEMBL1894187 0.79 AKR1C3 (0.42) MEN1KMT2ANR1I2AKR1C3ALDH1A1
SCHEMBL6729814 0.75 LMNA (0.51) MEN1KMT2ANR1I2AKR1C3ALDH1A1
SCHEMBL11015943 0.74 CYP3A4 (0.42) MEN1KMT2ANR1I2AKR1C3ALDH1A1
SCHEMBL2219176 0.73 TDP1 (0.59) LMNATDP1PTGS2
SCHEMBL28013343 0.73 TDP1 (0.59) LMNATDP1PTGS2
SCHEMBL7178451 0.73 FBP1 (0.38) MEN1KMT2AAKR1C3ALDH1A1TSHR
SCHEMBL28675711 0.73 RECQL (0.51) MEN1KMT2ANR1I2AKR1C3ALDH1A1
SCHEMBL6543446 0.70 CMA1 (0.44) MEN1KMT2ANR1I2AKR1C3ALDH1A1
SCHEMBL28878662 0.70 TSHR (0.41) MEN1KMT2ANR1I2AKR1C3ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018132239-A1 DYE-FREE NAIL VARNISH COMPOSITIONS AND METHODS THEREOF L'OREAL (FR) 2018-07-19 WO claimed
US-20180192758-A1 DYE-FREE NAIL VARNISH COMPOSITIONS AND METHODS THEREOF L'ORÉAL (FR) 2018-07-12 US claimed