SCHEMBL9515929

SCHEMBL9515929

Clc1ccc(SCCSc2ccc(Cl)c(Cl)c2)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
DAO P14920 1/20 0.44
AHR P35869 2/20 0.42
TP53 P04637 1/20 0.42
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
HAO1 Q9UJM8 1/20 0.40
IDO1 P14902 1/20 0.39
FBP1 P09467 1/20 0.39
MPI P34949 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GRIN1 Q05586 1/20 0.38
GRIN2B Q13224 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL6815592 0.89 PNMT (0.47) TDP1HTTNPSR1DAOAHR
SCHEMBL10410234 0.87 CDK1 (0.45) TDP1HTTNPSR1DAOAHR
SCHEMBL9040127 0.85 TDP1 (0.40) TDP1HTTNPSR1DAOAHR
SCHEMBL7531348 0.83 KIF11 (0.42) TDP1HTTNPSR1DAOHAO1
SCHEMBL15960057 0.83 THRB (0.48) TDP1HTTNPSR1DAOMPI
SCHEMBL9696956 0.83 DAO (0.42) TDP1HTTNPSR1DAOAHR
SCHEMBL10915572 0.82 MPI (0.39) TDP1HTTNPSR1DAOTP53
SCHEMBL9478091 0.82 THRB (0.41) TDP1HTTNPSR1DAOALDH1A1
SCHEMBL10499652 0.82 HTT (0.39) TDP1HTTNPSR1DAOTP53
SCHEMBL6496327 0.81 TP53 (0.44) TDP1HTTNPSR1DAOAHR

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-0345847-B1 PROCESS FOR THE PREPARATION OF POLYMERS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1993-08-04 EP disclosed
EP-0345847-A1 Process for the preparation of polymers SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1989-12-13 EP disclosed