SCHEMBL13689531

SCHEMBL13689531

CN(CC(c1ccccc1)c1ccccc1)C(=O)[C@H](CCCN1CCCCC1)NCCNC(=O)/C=C/c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DRD3 P35462 10/20 0.52
▸ DRD2 P14416 9/20 0.52
▸ ALOX5 P09917 1/20 0.43
▸ PYGL P06737 1/20 0.43
▸ OPRL1 P41146 1/20 0.42
▸ HSP90AA1 P07900 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ KMT2A Q03164 1/20 0.41

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
SCHEMBL13190970 0.94 DRD2 (0.51) DRD3DRD2ALOX5PYGLSMN1; SMN2
SCHEMBL13691792 0.94 DRD2 (0.52) DRD3DRD2ALOX5PYGLSMN1; SMN2
SCHEMBL13691795 0.87 DRD3 (0.47) DRD3DRD2ALOX5PYGLOPRL1
SCHEMBL13190971 0.84 MC4R (0.48) DRD3DRD2KMT2A
SCHEMBL13188833 0.82 DRD2 (0.46) DRD3DRD2ALOX5PYGLSMN1; SMN2
SCHEMBL13691856 0.81 DRD2 (0.47) DRD3DRD2ALOX5PYGLKMT2A
SCHEMBL13689519 0.80 LMNA (0.48) SMN1; SMN2KMT2A
SCHEMBL13689399 0.80 LMNA (0.43) SMN1; SMN2KMT2A
SCHEMBL13689526 0.80 SMYD2 (0.45) DRD3DRD2KMT2A
SCHEMBL13689521 0.79 OPRK1 (0.51) DRD3DRD2

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-2009105824-A1 METHODS OF MODULATING THE ACTIVITY OF THE MC5 RECEPTOR AND TREATMENT OF CONDITIONS RELATED TO THIS RECEPTOR MIMETICA PTY LTD (AU) 2009-09-03 — — WO disclosed
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