SCHEMBL8714745

SCHEMBL8714745

CCCCc1c(N2CCCC(NC(=O)c3ccccc3)C2)ccc2c1C(C(=O)NCCC)c1ccccc1-2

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 3/20 0.41
▸ DRD2 P14416 2/20 0.39
▸ DRD4 P21917 2/20 0.39
▸ DRD3 P35462 2/20 0.39
▸ CCR2 P41597 1/20 0.38
▸ PPARD Q03181 2/20 0.38
▸ PPARA Q07869 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ OPRM1 P35372 1/20 0.37
▸ OPRK1 P41145 1/20 0.37
▸ HPGD P15428 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ CARM1 Q86X55 1/20 0.36
▸ PRMT6 Q96LA8 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ BTK Q06187 2/20 0.36
▸ HSD11B1 P28845 1/20 0.36
▸ USP30 Q70CQ3 1/20 0.35

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
SCHEMBL8669688 0.96 DRD2 (0.39) CHRM1DRD2DRD4DRD3CARM1
SCHEMBL8502239 0.93 DRD2 (0.39) CHRM1DRD2DRD4DRD3GAA
SCHEMBL8665881 0.88 DRD2 (0.37) CHRM1DRD2DRD4DRD3CARM1
SCHEMBL8666097 0.85 DRD2 (0.36) CHRM1DRD2DRD4DRD3CARM1
SCHEMBL8480929 0.84 DRD2 (0.44) DRD2DRD4DRD3HPGDKMT2A
SCHEMBL8501237 0.84 MTTP (0.36) CHRM1DRD2DRD4DRD3GAA
SCHEMBL8480412 0.83 DRD2 (0.37) DRD2DRD4DRD3GAAHPGD
SCHEMBL8501050 0.82 MTTP (0.36) CHRM1DRD2DRD4DRD3GAA
SCHEMBL8668074 0.80 DRD2 (0.37) DRD2DRD4DRD3GAAHPGD
SCHEMBL8675068 0.78 L3MBTL1 (0.42) DRD2DRD4DRD3GAAHPGD

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
US-5739135-A PREVENTING OR TREATING ATHEROSCLEROSIS, PANCREATITIS SECONDARY TO HYPERTRIGLYCERIDEMIA, HYPERGLYCEMIA, OBESITY BRISTOL-MYERS SQUIBB COMPANY (US) 1998-04-14 — — US disclosed
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