SCHEMBL10955574

SCHEMBL10955574

CCOC(=O)C(c1ccccc1)C1CCCCC1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.70
SLC6A3 Q01959 4/20 0.70
CYP3A4 P08684 2/20 0.70
TSHR P16473 2/20 0.70
LMNA P02545 2/20 0.70
CHRM2 P08172 1/20 0.70
HTR1A P08908 1/20 0.70
ADRA2A P08913 1/20 0.70
CHRM1 P11229 1/20 0.70
DRD1 P21728 1/20 0.70
ADRA1A P35348 1/20 0.70
OPRM1 P35372 1/20 0.70
DRD3 P35462 1/20 0.70
KCNH2 Q12809 1/20 0.70
CYP1A2 P05177 1/20 0.70
CYP2D6 P10635 1/20 0.70
SLC6A4 P31645 2/20 0.65
CHRM3 P20309 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.54
HTR1E P28566 2/20 0.53

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
SCHEMBL28632940 0.98 SLC6A2 (0.67) SLC6A2SLC6A3CYP3A4TSHRLMNA
SCHEMBL30771364 0.87 SLC6A2 (0.56) SLC6A2SLC6A3CYP3A4TSHRLMNA
SCHEMBL8193192 0.85 SLC6A2 (0.65) SLC6A2SLC6A3CYP3A4TSHRLMNA
SCHEMBL4950911 0.84 SLC6A3 (0.63) SLC6A2SLC6A3CYP3A4TSHRLMNA
SCHEMBL28622583 0.84 SLC6A2 (0.69) SLC6A2SLC6A3CYP3A4TSHRLMNA
SCHEMBL7489656 0.84 SLC6A2 (0.68) SLC6A2SLC6A3CYP3A4TSHRLMNA
SCHEMBL28627235 0.84 SLC6A3 (0.61) SLC6A2SLC6A3CYP3A4TSHRLMNA
SCHEMBL11932077 0.84 SLC6A3 (0.51) SLC6A2SLC6A3CYP3A4TSHRLMNA
SCHEMBL28622638 0.83 SLC6A3 (0.67) SLC6A2SLC6A3CYP3A4TSHRLMNA
SCHEMBL4206472 0.83 SLC6A3 (0.65) SLC6A2SLC6A3CYP3A4TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101932562-A Carbamoyl compounds as dgat1 inhibitors 190 ASTRAZENECA AB 2010-12-29 CN disclosed
US-4531008-A Insecticide, miticide SUMITOMO CHEMICAL CO., LTD. (JP) 1985-07-23 US disclosed
US-4266074-A SUBSTITUTED PHENYL BUTENYL ACETATES SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1981-05-05 US disclosed
US-4062968-A MITICIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-12-13 US disclosed
US-4058622-A Substituted phenyl acetate, insecticidal composition and method of use SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-11-15 US disclosed
US-4039680-A SULFUR CONTAINING HETEROCYCLES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-08-02 US disclosed
US-4031235-A Insecticidal substituted acetate compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-06-21 US disclosed
US-3996244-A Insecticidal esters of substituted furan methanol SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-12-07 US disclosed