SCHEMBL9696233

SCHEMBL9696233

Cc1ccc2c(=O)c(Cl)c[nH]c2n1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 19/20 0.62
ADORA1 P30542 12/20 0.62
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54

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
SCHEMBL8269302 0.85 ADORA2A (0.55) ADORA2AADORA1MEN1KMT2A
SCHEMBL9695804 0.79 ADORA2A (0.55) ADORA2AADORA1MEN1KMT2A
SCHEMBL8424799 0.76 MEN1 (0.68) ADORA2AADORA1MEN1KMT2A
SCHEMBL7922469 0.74 ADORA2A (0.53) ADORA2AADORA1MEN1KMT2A
SCHEMBL8039008 0.73 ADORA1 (1.00) ADORA2AADORA1KMT2A
SCHEMBL5744628 0.72 ADORA2A (0.39) ADORA2AADORA1MEN1KMT2A
SCHEMBL24859567 0.71 ADORA2A (0.57) ADORA2AADORA1MEN1KMT2A
SCHEMBL9696036 0.71 ALDH1A1 (0.42) ADORA2AADORA1MEN1KMT2A
SCHEMBL26978227 0.71 ADORA2A (0.51) ADORA2AADORA1MEN1KMT2A
SCHEMBL30559755 0.71 ADORA2A (0.51) ADORA2AADORA1MEN1KMT2A

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
WO-1992007468-A1 HERBICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-05-14 WO disclosed