SCHEMBL4367663

SCHEMBL4367663

CCCCC(C)(CCCCC(=O)O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.58
GPR84 Q9NQS5 7/20 0.56
PPARG P37231 7/20 0.56
PPARD Q03181 7/20 0.56
PPARA Q07869 7/20 0.56
HDAC11 Q96DB2 5/20 0.56
TSHR P16473 4/20 0.56
PTPN1 P18031 3/20 0.56
FABP4 P15090 3/20 0.56
ALDH1A1 P00352 2/20 0.56
TLR2 O60603 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
KMT2A Q03164 2/20 0.56
ALOX15 P16050 2/20 0.56
HSD17B10 Q99714 2/20 0.56
SLC22A6 Q4U2R8 1/20 0.56
SLC22A8 Q8TCC7 1/20 0.56
MEN1 O00255 1/20 0.56
ESR1 P03372 1/20 0.56
PDE4A P27815 1/20 0.56

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
SCHEMBL17950996 0.94 GPR84 (0.65) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL27998659 0.94 GPR84 (0.65) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL15988191 0.94 GPR84 (0.65) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL14796469 0.94 GPR84 (0.65) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL2139329 0.94 AKR1B1 (0.54) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL23514258 0.92 AKR1B1 (0.52) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL11309130 0.92 LMNA (0.52) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL21175088 0.90 GPR84 (0.59) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL2137158 0.90 AKR1B1 (0.48) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL9175772 0.89 TSHR (0.44) AKR1B1GPR84PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2287147-B1 2-Amino-bicyclo[3.1.0]hexane-2,6-dicarboxylic ester derivative TAISHO PHARMACEUTICAL CO LTD (JP) 2013-05-15 EP disclosed
EP-2123630-A1 2-Amino-bicyclo[3.1.0]hexane-2,6-dicarboxylic ester derivative Taisho Pharmaceutical Co. Ltd. (JP) 2009-11-25 EP disclosed
EP-1637517-A1 2-AMINOBICYCLO 3.1.0 HEXANE-2,6-DICARBOXYLIC ESTER DERIVATIVE Taisho Pharmaceutical Co. Ltd. (JP) 2006-03-22 EP disclosed