SCHEMBL7919054

SCHEMBL7919054

CC(C)c1cc(S(=O)(=O)O)cc2c1CCC2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ING2 Q9H160 1/20 0.42
FABP3 P05413 1/20 0.40
FABP4 P15090 1/20 0.40
FABP5 Q01469 1/20 0.40
ATM Q13315 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 3/20 0.37
LMNA P02545 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL7790501 0.97 ING2 (0.42) ING2FABP3FABP4FABP5ATM
SCHEMBL7916036 0.81 ING2 (0.46) ING2SMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL7788614 0.77 ING2 (0.46) ING2SMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL7909272 0.77 ING2 (0.46) ING2ALDH1A1KDM4ENLRP3CA12
SCHEMBL7916023 0.77 ING2 (0.42) ING2ATMSMN1; SMN2ALDH1A1LMNA
SCHEMBL7909293 0.77 ING2 (0.42) ING2SMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL7921993 0.75 ING2 (0.41) ING2ALDH1A1LMNAMEN1HPGD
SCHEMBL7787696 0.74 ING2 (0.46) ING2ALDH1A1LMNAKDM4EMEN1
SCHEMBL7787716 0.74 ING2 (0.50) ING2ALDH1A1KDM4EMEN1GAA
SCHEMBL7782777 0.73 ING2 (0.42) ING2SMN1; SMN2ALDH1A1LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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