SCHEMBL8599741

SCHEMBL8599741

CCCOC(=O)Oc1cc(N=C=S)c(F)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CUL4A Q13619 1/20 0.35
ELANE P08246 5/20 0.34
HTT P42858 1/20 0.32
RECQL P46063 1/20 0.32
ALDH1A1 P00352 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 2/20 0.32
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ESR1 P03372 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
KLK7 P49862 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
SCHEMBL8598193 0.94 ELANE (0.39) CUL4AELANEHTTRECQLALDH1A1
SCHEMBL8598539 0.92 ELANE (0.38) ELANEHTTRECQLALDH1A1L3MBTL1
SCHEMBL8601864 0.90 CUL4A (0.44) CUL4AELANE
SCHEMBL8599287 0.84 L3MBTL1 (0.48) HTTRECQLALDH1A1L3MBTL1TDP1
SCHEMBL8603030 0.84 CUL4A (0.40) CUL4AHTTALDH1A1LMNANPSR1
SCHEMBL8602400 0.81 DHODH (0.32) MAPT
SCHEMBL8599225 0.81 PPOX (0.40) HTTRECQLALDH1A1L3MBTL1NPSR1
SCHEMBL8599624 0.81 CUL4A (0.31) CUL4AMAPT
SCHEMBL8598105 0.81 ELANE (0.35) ELANE
SCHEMBL9814276 0.79 CUL4A (0.44) CUL4AALDH1A1TDP1CYP1A2CYP2C19

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
EP-0626370-B1 Process for producing aromatic isothiocyanate derivatives SUMITOMO CHEMICAL CO (JP) 1998-02-11 EP disclosed
EP-0626370-A1 Process for producing aromatic isothiocyanate derivatives SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1994-11-30 EP disclosed