SCHEMBL11441561

SCHEMBL11441561

CCCN(CCNCCc1ccc(OC)cc1)CC1CC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ ADRA1D P25100 1/20 0.46
▸ ADRA1A P35348 1/20 0.46
▸ ADRA1B P35368 1/20 0.46
▸ DRD2 P14416 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ SMPD1 P17405 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ HTT P42858 2/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ MAOB P27338 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ATM Q13315 1/20 0.40

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
SCHEMBL11429899 0.91 ADRA1D (0.46) KDM4EADRA1DADRA1AADRA1BSMPD1
SCHEMBL11437547 0.88 ACACB (0.44) GAASMN1; SMN2MEN1KMT2A
SCHEMBL11434849 0.84 OPRM1 (0.54) DRD2DRD3
SCHEMBL11429882 0.83 ADRA1D (0.51) ADRA1DADRA1AADRA1BSMPD1GAA
SCHEMBL11435253 0.83 KMT2A (0.48) ADRA1DADRA1AADRA1BGAASMN1; SMN2
SCHEMBL11435182 0.80 ACACB (0.39) KDM4EADRA1DADRA1AADRA1BSMN1; SMN2
SCHEMBL11436980 0.77 DRD2 (0.51) ADRA1DADRA1AADRA1BDRD2DRD3
SCHEMBL11442594 0.77 SMN1; SMN2 (0.44) KDM4EGAAHTTSMN1; SMN2MEN1
SCHEMBL11435585 0.75 BCHE (0.53) MEN1KMT2A
SCHEMBL1966331 0.75 ADRA1D (0.67) KDM4EADRA1DADRA1AADRA1BGAA

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-0017376-A1 Phenylacetamide compounds and an analgesic composition containing them KISSEI PHARMACEUTICAL CO. LTD (JP) 1980-10-15 — — EP disclosed
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