SCHEMBL3669925

SCHEMBL3669925

CCCc1c(N)ccc(S)c1CCC

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 1/20 0.37
SKP2 Q13309 1/20 0.33
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
GAA P10253 2/20 0.31
HPGD P15428 2/20 0.31
MAPT P10636 1/20 0.30
THRB P10828 1/20 0.30
HTT P42858 1/20 0.30
GFER P55789 1/20 0.30
PLEC Q15149 1/20 0.30

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
SCHEMBL3670348 0.92 SKP2 (0.44) NOS2SKP2HPGDHTT
SCHEMBL3672876 0.92 SKP2 (0.44) NOS2SKP2HPGDHTT
SCHEMBL3671141 0.92 NOS2 (0.35) NOS2SKP2KDM4E
SCHEMBL3678230 0.88 SKP2 (0.47) NOS2SKP2HPGDHTT
SCHEMBL458150 0.86 NOS2 (0.45) NOS2SKP2KDM4EALDH1A1GAA
SCHEMBL3675442 0.83 NOS2 (0.39) NOS2SKP2
SCHEMBL3668718 0.80 SKP2 (0.44) NOS2SKP2KDM4EHPGDHTT
SCHEMBL3678897 0.77 ALDH1A1 (0.33) NOS2KDM4EALDH1A1HPGDMAPT
SCHEMBL1534142 0.76 NOS2 (0.38) NOS2SKP2KDM4EALDH1A1GAA
SCHEMBL2495189 0.76 NOS2 (0.52) NOS2SKP2KDM4EALDH1A1GAA

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
EP-1426392-B1 COMPOSITION FOR OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2010-02-24 EP disclosed
US-6960640-B2 Composition for optical material MITSUBISHI GAS CHEMICAL CO., LTD. (JP) 2005-11-01 US disclosed
US-20040147708-A1 Composition for optical material MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-07-29 US disclosed
EP-1426392-A1 COMPOSITION FOR OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-06-09 EP disclosed