SCHEMBL3833231

SCHEMBL3833231

Clc1cc(Br)cc2[nH]c[c]c12

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.31
NMT1 P30419 1/20 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
SCHEMBL4885600 0.74 CSNK2A1 (0.32)
SCHEMBL9167984 0.68
SCHEMBL207535 0.67 AHR (0.42) AHR
SCHEMBL321694 0.67 GPR84 (0.41) AHR
SCHEMBL152187 0.64 CSNK2A1 (0.44) AHR
SCHEMBL6928459 0.63 CYP3A4 (0.36)
SCHEMBL1020404 0.61 RHEB (0.50) AHR
SCHEMBL29506983 0.61 RHEB (0.50) AHR
SCHEMBL207906 0.60 HTR1A (0.31)
SCHEMBL22749322 0.59 CYP2A6 (0.39) NMT1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1196624-B1 TEST MEDIA FOR IDENTIFICATION AND DIFFERENTIATION OF ENTEROBACTERIACEAE MICROLOGY LAB L L C (US) 2009-09-23 EP disclosed