SCHEMBL7782777

SCHEMBL7782777

CCc1cc(S(=O)(=O)O)cc2c1CCCC2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ING2 Q9H160 1/20 0.42
GNG2 P59768 1/20 0.39
GNB1 P62873 1/20 0.39
ALDH1A1 P00352 6/20 0.35
LMNA P02545 5/20 0.35
TSHR P16473 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NLRP3 Q96P20 2/20 0.34
KDM4E B2RXH2 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
SLC2A1 P11166 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MAPT P10636 2/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
TP53 P04637 1/20 0.34
THRB P10828 1/20 0.34
MAPK1 P28482 2/20 0.33
KMT2A Q03164 2/20 0.33
GLA P06280 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
SCHEMBL7909293 0.97 ING2 (0.42) ING2GNG2GNB1ALDH1A1LMNA
SCHEMBL7782786 0.86 LMNA (0.38) ING2GNG2GNB1ALDH1A1LMNA
SCHEMBL7909265 0.83 LMNA (0.37) ING2ALDH1A1LMNATSHRL3MBTL1
SCHEMBL7788614 0.81 ING2 (0.46) ING2ALDH1A1LMNANLRP3SMN1; SMN2
SCHEMBL7916036 0.77 ING2 (0.46) ING2ALDH1A1LMNANLRP3SMN1; SMN2
SCHEMBL7787696 0.77 ING2 (0.46) ING2ALDH1A1LMNANLRP3KDM4E
SCHEMBL7787716 0.77 ING2 (0.50) ING2ALDH1A1L3MBTL1NLRP3KDM4E
SCHEMBL7790501 0.77 ING2 (0.42) ING2ALDH1A1LMNATSHRL3MBTL1
SCHEMBL7787697 0.77 ING2 (0.42) ING2ALDH1A1LMNATSHRL3MBTL1
SCHEMBL7790547 0.76 ING2 (0.44) ING2ALDH1A1TSHRL3MBTL1NLRP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672405-B1 Hair treatment composition KAO CORP (JP) 2001-11-14 EP disclosed
US-6217855-B1 ELASTICITY KAO CORPORATION (JP) 2001-04-17 US disclosed
EP-0529437-B1 Hair treatment composition KAO CORP (JP) 1996-07-17 EP disclosed
EP-0672405-A1 Hair treatment composition KAO CORPORATION (JP) 1995-09-20 EP disclosed
EP-0529437-A1 Hair treatment composition Kao Corporation (JP) 1993-03-03 EP disclosed