SCHEMBL27318149

SCHEMBL27318149

Clc1ccc(-c2c[nH]cn2)c(Cl)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.39
ALPL P05186 3/20 0.39
IDO1 P14902 1/20 0.33
CES1 P23141 1/20 0.32
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
CNR2 P34972 2/20 0.31

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
SCHEMBL6812754 0.76 HSP90AA1 (0.45) AHRALPLIDO1MAPK1
SCHEMBL6706693 0.76 IDO1 (0.50) IDO1CYP3A4CNR2
SCHEMBL30697682 0.74 IDO1 (0.48) ALPLIDO1CNR2
SCHEMBL29222666 0.72
SCHEMBL26259398 0.71 MEN1 (0.33)
SCHEMBL4864735 0.70 CHRNB2 (0.36)
SCHEMBL12781980 0.69 AHR (0.48) AHR
SCHEMBL29746130 0.68 TSHR (0.46) CYP3A4
SCHEMBL23716669 0.68
SCHEMBL308791 0.68 AHR (0.62) AHRALPLCES1CYP3A4MAPK1

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
CN-1027125-C Fungicidal compositions SCHERING AGROCHEMICALS LTD (GB) 1994-12-28 CN disclosed
CN-88101622-A Fungicidal agents 1988-10-05 CN disclosed