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SCHEMBL17835239

SCHEMBL17835239

O=NC(=O)C1CCCCC1C(=O)Nc1cc(Cl)cc(Cl)c1

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 9/20 0.73
▸ MEN1 O00255 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ POLB P06746 1/20 0.55
▸ HTT P42858 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ CYP2C19 P33261 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.48
▸ MAPK1 P28482 1/20 0.47

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
SCHEMBL17833259 0.86 GAA (0.58) GRM4MEN1KMT2APOLBHTT
SCHEMBL359675 0.84 GRM4 (1.00) GRM4MEN1KMT2APOLBHTT
SCHEMBL15060591 0.84 GRM4 (1.00) GRM4MEN1KMT2APOLBHTT
SCHEMBL367814 0.84 GRM4 (1.00) GRM4MEN1KMT2APOLBHTT
SCHEMBL14698148 0.84 GRM4 (1.00) GRM4MEN1KMT2APOLBHTT
SCHEMBL20277498 0.77 GRM4 (0.83) GRM4MEN1KMT2APOLBHTT
SCHEMBL2246735 0.74 MEN1 (0.96) GRM4MEN1KMT2AALDH1A1
SCHEMBL367815 0.73 GRM4 (0.63) GRM4MEN1KMT2APOLBHTT
SCHEMBL18154026 0.72 MEN1 (0.86) GRM4MEN1KMT2AHTTALDH1A1
SCHEMBL5950689 0.71 GRM4 (0.68) GRM4MEN1KMT2APOLBHTT

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-2016094690-A1 FLAVOR COMPOSITIONS AND PET FOOD PRODUCTS CONTAINING THE SAME MARS, INCORPORATED (US) 2016-06-16 — — WO disclosed