SCHEMBL6551234

SCHEMBL6551234

CC(=O)n1cc([PH](O)(Cl)Cl)c2c(Cl)c(Br)ccc21

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.37
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL3282414 0.82 NOTUM (0.41) NOTUMMEN1KMT2AHTT
SCHEMBL32691742 0.76 NOTUM (0.36) NOTUMHTT
SCHEMBL25288671 0.75 AKR1C3 (0.42) NOTUM
SCHEMBL6551232 0.75 NOTUM (0.35) NOTUM
SCHEMBL7108455 0.73 NOTUM (0.34) NOTUM
SCHEMBL6551187 0.66
SCHEMBL11213858 0.66
SCHEMBL2804217 0.64 HTR2A (0.34) MEN1KMT2A
SCHEMBL3564119 0.64 NOTUM (0.41) NOTUMMEN1KMT2AHTT
SCHEMBL3437628 0.63 CFD (0.33) HTT

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-0970239-B1 DETECTION OF MICROBIAL METABOLITES BIOSYNTH AG (CH) 2004-12-08 EP disclosed