SCHEMBL8599277

SCHEMBL8599277

CCOC(=O)Sc1cc(N=C=S)c(F)cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
ALOX15 P16050 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
GRM6 O15303 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL8600432 0.91 HTT (0.32)
SCHEMBL8600587 0.90 ESR1 (0.37) ALDH1A1LMNATDP1
SCHEMBL8601876 0.88 ESR1 (0.36) ALDH1A1LMNATDP1
SCHEMBL8603109 0.86 MAPT (0.33) LMNA
SCHEMBL8598592 0.84
SCHEMBL8604172 0.83 ALDH1A1 (0.39) ALDH1A1LMNAALOX15
SCHEMBL8600251 0.83 POLB (0.30)
SCHEMBL8602181 0.83
SCHEMBL8602688 0.82 MAPT (0.37) ALDH1A1LMNAALOX15TDP1
SCHEMBL8603097 0.82

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