SCHEMBL8024134

SCHEMBL8024134

O=C(Br)Cc1ccc(-c2ccccc2)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.50
ACE P12821 3/20 0.50
ESR2 Q92731 1/20 0.50
ERCC5 P28715 1/20 0.45
FEN1 P39748 1/20 0.45
DGAT1 O75907 1/20 0.44
AKR1C2 P52895 1/20 0.44
AKR1C1 Q04828 1/20 0.44
ABCC4 O15439 1/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.43
PTGS1 P23219 1/20 0.43
HTT P42858 1/20 0.43
DCLRE1A Q6PJP8 1/20 0.42
DCLRE1B Q9H816 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HPGD P15428 1/20 0.41
ACLY P53396 1/20 0.41
HIF1A Q16665 1/20 0.41

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
SCHEMBL7391266 0.88 DGAT1 (0.54) MMEACEESR2ERCC5FEN1
SCHEMBL6299131 0.78 ESR2 (0.57) MMEACEESR2ERCC5FEN1
SCHEMBL5215840 0.78 ESR2 (0.52) MMEACEESR2ERCC5FEN1
SCHEMBL458111 0.78 ESR2 (0.52) MMEACEESR2ERCC5FEN1
SCHEMBL15822666 0.77 DGAT1 (0.54) MMEACEERCC5FEN1DGAT1
SCHEMBL7698653 0.77 ESR2 (0.50) MMEACEESR2ERCC5FEN1
SCHEMBL4936159 0.76 DGAT1 (0.53) MMEACEESR2DGAT1
SCHEMBL6308178 0.76 ESR2 (0.53) MMEACEESR2ERCC5FEN1
SCHEMBL7096241 0.76 ESR2 (0.46) MMEACEESR2ERCC5FEN1
SCHEMBL31369574 0.74 MME (0.55) MMEACEPTGS1

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-0979079-A1 USE OF TETRAHYDROPYRIDINE DERIVATIVES TO PREPARE MEDICINES FOR TREATING DISEASES CAUSING DEMYELINATION SANOFI-SYNTHELABO (FR) 2000-02-16 EP disclosed
EP-0950053-A1 USE OF BENZOYLALKYL-1,2,3,6-TETRAHYDROPYRIDINS SANOFI (FR) 1999-10-20 EP disclosed
WO-1998048802-A1 USE OF TETRAHYDROPYRIDINE DERIVATIVES TO PREPARE MEDICINES FOR TREATING DISEASES CAUSING DEMYELINATION SANOFI-SYNTHELABO (FR) 1998-11-05 WO disclosed
WO-1998028274-A1 USE OF BENZOYLALKYL-1,2,3,6-TETRAHYDROPYRIDINS SANOFI (FR) 1998-07-02 WO disclosed