SCHEMBL8474346

SCHEMBL8474346

C=CCN1CCc2cc(C(N)=O)ccc2C1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.59
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
HTR1A P08908 1/20 0.46
DRD2 P14416 1/20 0.46
HTR2A P28223 1/20 0.46
HTR7 P34969 1/20 0.46
HRH1 P35367 1/20 0.46
DRD3 P35462 1/20 0.46
HTR2B P41595 1/20 0.46
HSD17B3 P37058 1/20 0.45
OPRM1 P35372 4/20 0.43
OPRD1 P41143 4/20 0.43
OPRK1 P41145 4/20 0.43
ITGB3 P05106 2/20 0.43
ITGA2B P08514 2/20 0.43
PRMT5 O14744 5/20 0.42
WDR77 Q9BQA1 5/20 0.42
MAP3K5 Q99683 1/20 0.42
ENPP2 Q13822 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
SCHEMBL6961088 0.79 PLAU (0.47) PLAUDRD2HTR2AHRH1DRD3
SCHEMBL10673802 0.79 DRD1 (0.53) PLAUDRD2DRD3PRMT5
SCHEMBL23395332 0.78 MEN1 (0.50) MEN1KMT2AHTR1ADRD2HTR2A
SCHEMBL20909775 0.76 PLAU (0.45) PLAUMEN1KMT2ADRD2DRD3
SCHEMBL28752685 0.74 DRD2 (0.49) MEN1KMT2AHTR1ADRD2HTR2A
SCHEMBL30620400 0.74 HSD17B3 (0.55) MEN1KMT2AHTR1ADRD2HTR2A
SCHEMBL26161459 0.74 HSD17B3 (0.55) MEN1KMT2AHTR1ADRD2HTR2A
SCHEMBL27361573 0.74 MEN1 (0.60) MEN1KMT2AHTR1ADRD2HTR2A
SCHEMBL20884109 0.73 PLAU (0.43) PLAUMEN1KMT2ADRD2DRD3
Acetic Acid SCHEMBL6519592 0.73 HDAC3 (0.52) MEN1KMT2AHTR1ADRD2HTR2A

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-5919795-A ATHEROSCLEROSIS THERAPY PFIZER INC. (US) 1999-07-06 US disclosed