SCHEMBL6960074

SCHEMBL6960074

O=CCC1CCc2ccccc2C1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.50
PLAU P00749 1/20 0.46
HTR1A P08908 2/20 0.45
SIGMAR1 Q99720 2/20 0.45
OPRM1 P35372 1/20 0.44
OPRL1 P41146 1/20 0.44
PREP P48147 4/20 0.44
NPY1R P25929 3/20 0.43
NPY5R Q15761 3/20 0.43
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
MTNR1A P48039 2/20 0.41
MTNR1B P49286 2/20 0.41
GBA1 P04062 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
SCHEMBL833464 0.86 IDO1 (0.42) CYP19A1SIGMAR1PREP
SCHEMBL6429735 0.81 CYP19A1 (0.50) CYP19A1PLAUHTR1ASIGMAR1OPRM1
SCHEMBL9935276 0.79 CYP19A1 (0.54) CYP19A1PLAUHTR1ASIGMAR1OPRM1
SCHEMBL6427473 0.77 PREP (0.50) CYP19A1PREPNPY1RNPY5RADRA1D
SCHEMBL8414318 0.77 CHRM2 (0.67) CYP19A1SIGMAR1CHRM2CHRM1CHRM3
SCHEMBL12422869 0.77 ADRA1D (0.58) CYP19A1PLAUHTR1ASIGMAR1NPY1R
SCHEMBL7304447 0.76 DGAT1 (0.58) CYP19A1HTR1ASIGMAR1PREPMTNR1A
SCHEMBL3406500 0.76 DGAT1 (0.58) CYP19A1HTR1ASIGMAR1PREPMTNR1A
SCHEMBL7292707 0.76 DGAT1 (0.58) CYP19A1HTR1ASIGMAR1PREPMTNR1A
SCHEMBL30612421 0.76 DGAT1 (0.58) CYP19A1HTR1ASIGMAR1PREPMTNR1A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1010693-B1 Imidazoline derivatives, preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-09-24 EP disclosed
US-6127396-A Imidazoline compounds ADIR ET COMPAGNIE (FR) 2000-10-03 US disclosed
EP-0194764-B1 PESTICIDAL COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1989-07-12 EP disclosed
EP-0194764-A1 Pesticidal compounds THE WELLCOME FOUNDATION LIMITED (GB) 1986-09-17 EP disclosed