SCHEMBL6424778

SCHEMBL6424778

O=C(NC1CCN(C/C=C/c2ccccc2)CC1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 7/20 1.00
▸ CCR3 P51677 1/20 0.84
▸ CARM1 Q86X55 1/20 0.63
▸ PRMT6 Q96LA8 1/20 0.63
▸ KDM4E B2RXH2 2/20 0.60
▸ ALDH1A1 P00352 1/20 0.60
▸ ADRA1D P25100 1/20 0.57
▸ ADRA1A P35348 1/20 0.57
▸ ADRA1B P35368 1/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ PKM P14618 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ POLB P06746 1/20 0.56
▸ LMNA P02545 1/20 0.56
▸ GAA P10253 1/20 0.56
▸ CHRM3 P20309 1/20 0.55

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
SCHEMBL6424782 1.00 MCHR1 (1.00) MCHR1CCR3CARM1PRMT6KDM4E
SCHEMBL14067116 0.79 CARM1 (0.70) MCHR1CCR3CARM1PRMT6ADRA1D
SCHEMBL3650292 0.78 CARM1 (0.68) MCHR1CCR3CARM1PRMT6ADRA1D
SCHEMBL7304622 0.78 S1PR1 (0.67) MCHR1CCR3KDM4EALDH1A1SMN1; SMN2
SCHEMBL18286474 0.78 CARM1 (0.72) MCHR1CARM1PRMT6ADRA1DADRA1A
SCHEMBL7304629 0.78 S1PR1 (0.67) MCHR1CCR3KDM4EALDH1A1SMN1; SMN2
SCHEMBL4977531 0.77 MCHR1 (0.63) MCHR1CCR3KDM4EALDH1A1SMN1; SMN2
SCHEMBL4977535 0.77 MCHR1 (0.63) MCHR1CCR3KDM4EALDH1A1SMN1; SMN2
SCHEMBL694949 0.77 SIGMAR1 (0.82) MCHR1SMN1; SMN2POLBLMNA
SCHEMBL11618865 0.77 CARM1 (0.75) MCHR1CARM1PRMT6ADRA1DADRA1A

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
JP-2005325031-A 1-CINNAMYLPIPERIDINE DERIVATIVE ASTELLAS PHARMA INC 2005-11-24 — — JP disclosed
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