SCHEMBL8107503

SCHEMBL8107503

O=C1CC(=O)OC(c2cccc(Cl)c2)(c2cccc(Cl)c2)O1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 1/20 0.42
HCAR2 Q8TDS4 1/20 0.42
HSD11B1 P28845 2/20 0.40
SLC6A3 Q01959 5/20 0.39
SLC6A4 P31645 4/20 0.39
CCR2 P41597 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
SLC6A2 P23975 4/20 0.36
HTR2C P28335 2/20 0.36
HTR2A P28223 1/20 0.36
HTR2B P41595 1/20 0.36
PGR P06401 1/20 0.36
CHRNA1 P02708 2/20 0.36
CHRNG P07510 2/20 0.36
CHRNB1 P11230 2/20 0.36
CHRNB2 P17787 2/20 0.36
CHRNB4 P30926 2/20 0.36
CHRNA3 P32297 2/20 0.36

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
SCHEMBL8115490 0.79 HCAR3 (0.42) HCAR3HCAR2HSD11B1SLC6A3SLC6A4
SCHEMBL8115288 0.77 KMT2A (0.40) HSD11B1SLC6A3SLC6A4CCR2MEN1
SCHEMBL8122274 0.77 CFTR (0.39) HCAR3HCAR2HSD11B1MEN1KMT2A
SCHEMBL8107180 0.75 HCAR2 (0.47) HCAR2SLC6A3MEN1KMT2AMAPT
SCHEMBL8122728 0.75 HCAR3 (0.47) HCAR3HCAR2MEN1KMT2AMAPT
SCHEMBL8121636 0.69 SLC6A4 (0.40) HCAR3HCAR2HSD11B1SLC6A3SLC6A4
SCHEMBL4472949 0.67 CNR1 (0.49) HCAR3HCAR2CCR2
SCHEMBL31332723 0.67 SLC6A4 (0.49) HCAR3HCAR2HSD11B1SLC6A3SLC6A4
SCHEMBL15647408 0.67 TAAR1 (0.49) KMT2A
SCHEMBL31332697 0.67 HSD11B1 (0.40) HCAR3HCAR2HSD11B1SLC6A3SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6114546-A Aminomethylene derivatives and ultraviolet absorbent comprising thereof CHEMIPRO KASEI KAISHA, LIMITED (JP) 2000-09-05 US disclosed
EP-0950655-A1 AMINOMETHYLENE DERIVATIVES AND ULTRAVIOLET ABSORBER COMPRISING THE SAME CHEMIPRO KASEI KAISHA, LIMITED (JP) 1999-10-20 EP disclosed