SCHEMBL10604253

SCHEMBL10604253

CCCC1(NC(=O)c2ccccc2)CCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.55
CTSL P07711 3/20 0.47
CTSK P43235 1/20 0.46
LMNA P02545 1/20 0.43
HSD17B10 Q99714 2/20 0.43
FAAH O00519 1/20 0.43
NAAA Q02083 1/20 0.43
CETP P11597 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
GAA P10253 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
APAF1 O14727 1/20 0.41
TDP2 O95551 1/20 0.41
NSD2 O96028 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ABL1 P00519 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
MAPT P10636 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
SCHEMBL27794391 0.95 ADRB2 (0.60) ADRB2CTSLCTSKLMNAHSD17B10
SCHEMBL10604425 0.91 ADRB2 (0.52) ADRB2CTSLCTSKLMNAHSD17B10
SCHEMBL10604416 0.90 ADRB2 (0.51) ADRB2CTSLCTSKLMNANAAA
SCHEMBL10607231 0.88 NAAA (0.52) ADRB2CTSLCTSKNAAACETP
SCHEMBL10607221 0.87 ADRB2 (0.57) ADRB2CTSLCTSKLMNAHSD17B10
SCHEMBL3645452 0.83 ADRB2 (0.53) ADRB2CTSLCTSKLMNAHSD17B10
SCHEMBL28022532 0.82 ADRB2 (0.47) ADRB2CTSLCTSKLMNAHSD17B10
SCHEMBL1186102 0.81 ADRB2 (0.57) ADRB2CTSLCTSKLMNAHSD17B10
SCHEMBL18314645 0.80 ADRB2 (0.52) ADRB2CTSLCTSKLMNAHSD17B10
SCHEMBL10610238 0.79 ADRB2 (0.76) ADRB2CTSLCTSKLMNAFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0182872-B1 A PROCESS FOR THE PREPARATION OF CYCLOBUTENE-SUBSTITUTED AROMATIC HYDROCARBONS THE DOW CHEMICAL COMPANY (US) 1989-11-08 EP disclosed
EP-0182872-A4 A PROCESS FOR THE PREPARATION OF CYCLOBUTENE-SUBSTITUTED AROMATIC HYDROCARBONS. DOW CHEMICAL CO (US) 1986-08-21 EP disclosed
EP-0182872-A1 A PROCESS FOR THE PREPARATION OF CYCLOBUTENE-SUBSTITUTED AROMATIC HYDROCARBONS. DOW CHEMICAL CO (US) 1986-06-04 EP disclosed
US-4570011-A PYROLYSIS OF AN ORTHO ALKYL HALOMETHYL AROMATIC HYDROCARBON IN AN INERT THE DOW CHEMICAL COMPANY (US) 1986-02-11 US disclosed
WO-1985005355-A1 A PROCESS FOR THE PREPARATION OF CYCLOBUTENE-SUBSTITUTED AROMATIC HYDROCARBONS THE DOW CHEMICAL COMPANY (US) 1985-12-05 WO disclosed