SCHEMBL4778859

SCHEMBL4778859

CC(C)c1cc(C(C)C)c([S+](c2ccccc2)c2ccccc2)c(C(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 2/20 0.41
FABP4 P15090 2/20 0.41
GABRA1 P14867 3/20 0.38
GABRB2 P47870 2/20 0.38
FABP5 Q01469 1/20 0.36
GABRB1 P18505 1/20 0.33
NR3C1 P04150 1/20 0.32
ADRA2A P08913 1/20 0.31
ADRA2C P18825 1/20 0.31
LMNA P02545 1/20 0.31
HIF1A Q16665 1/20 0.31
KDM4E B2RXH2 1/20 0.31
METAP2 P50579 1/20 0.31
IDH1 O75874 1/20 0.31
ROCK2 O75116 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL4777596 0.82 FABP3 (0.35) FABP3FABP4FABP5LMNA
SCHEMBL4771092 0.81 FABP4 (0.37) FABP3FABP4FABP5NR3C1
SCHEMBL4773393 0.80 FABP3 (0.36) FABP3FABP4FABP5NR3C1
SCHEMBL4779461 0.79 HSD11B1 (0.37) FABP3FABP4FABP5LMNAALDH1A1
SCHEMBL4776221 0.78 FABP3 (0.35) FABP3FABP4GABRA1GABRB2FABP5
SCHEMBL4779708 0.78 FABP3 (0.35) FABP3FABP4FABP5NR3C1
SCHEMBL3195775 0.75 TSHR (0.42) LMNAALDH1A1
SCHEMBL1953455 0.75 FABP4 (0.70) FABP3FABP4GABRA1GABRB2FABP5
SCHEMBL383991 0.75 FABP4 (0.47) FABP3FABP4FABP5NR3C1ALDH1A1
SCHEMBL29967874 0.73 USP5 (0.38) HIF1AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6899989-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2005-05-31 US claimed
US-20020090569-A1 Radiation-sensitive resin composition JSR CORPORATION (JP) 2002-07-11 US claimed
US-8206888-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2012-06-26 US disclosed
EP-1953593-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR Corporation (JP) 2008-08-06 EP disclosed
US-7060414-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2006-06-13 US disclosed
US-20050158657-A1 Radiation-sensitive resin composition SUZUKI AKI (JP) 2005-07-21 US disclosed
US-6899989-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2005-05-31 US disclosed
US-20020090569-A1 Radiation-sensitive resin composition JSR CORPORATION (JP) 2002-07-11 US disclosed