SCHEMBL6181971

SCHEMBL6181971

Clc1ccc(I)c(Cl)c1.[MgH2]

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.52
TSHR P16473 7/20 0.46
CYP3A4 P08684 4/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPK1 P28482 4/20 0.42
TDP1 Q9NUW8 3/20 0.42
AHR P35869 3/20 0.41
IDO1 P14902 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HIF1A Q16665 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
CASP1 P29466 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 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
SCHEMBL29588504 0.97
SCHEMBL767463 0.97
SCHEMBL5671038 0.94 TP53 (0.52) TP53TSHRCYP3A4HSD17B10MAPK1
Ether SCHEMBL3726510 0.83 TDP1 (0.40) TP53TSHRCYP3A4HSD17B10MAPK1
SCHEMBL29720648 0.74
SCHEMBL1350393 0.74
SCHEMBL79921 0.74
SCHEMBL3538617 0.74 AHR (0.55) TSHRCYP3A4MAPK1AHRALDH1A1
SCHEMBL5318805 0.73 TP53 (0.93) TP53TSHRCYP3A4HSD17B10MAPK1
SCHEMBL15823211 0.72 MAOA (0.48) TSHRALDH1A1CYP1A2CYP2C9CYP2C19

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-1105376-B1 OXINDOLE DERIVATIVES AS GROWTH HORMONE RELEASERS SUMITOMO PHARMA (JP) 2005-02-09 EP disclosed
US-6576656-B1 Such as 1-(2-diethylaminoethyl)-4-trifluoromethyl-6-carbamoyl-3-hydroxy-3-(2 -chlorophenyl)oxindole; growth hormone releaser SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2003-06-10 US disclosed