SCHEMBL10486233

SCHEMBL10486233

CC(C)CCCC(C)Cc1ccc(C(C)CC(=O)Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.40
PTGS1 P23219 4/20 0.40
PTGS2 P35354 4/20 0.40
CXCR1 P25024 3/20 0.40
CXCR2 P25025 3/20 0.40
ALOX5 P09917 3/20 0.40
LMNA P02545 2/20 0.40
CYP2C9 P11712 2/20 0.40
AKR1C3 P42330 2/20 0.40
ESR1 P03372 2/20 0.40
BLM P54132 2/20 0.40
ALB P02768 1/20 0.40
RARB P10826 1/20 0.40
ADRB3 P13945 1/20 0.40
NFKB1 P19838 1/20 0.40
HTR2A P28223 1/20 0.40
NR1I3 Q14994 1/20 0.40
SLC22A6 Q4U2R8 1/20 0.40
CXCL8 P10145 1/20 0.40
TSHR P16473 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
SCHEMBL9546062 0.87 FFAR1 (0.47) FAAHPTGS1PTGS2CXCR1CXCR2
SCHEMBL10485950 0.86 FFAR1 (0.46) FAAHPTGS1PTGS2CXCR1CXCR2
SCHEMBL9546047 0.79 POLB (0.44) FAAHPTGS1PTGS2ALOX5LMNA
SCHEMBL10486263 0.79 GRIN2D (0.42) FAAHPTGS1PTGS2CXCR1CXCR2
SCHEMBL10485947 0.78 OPRK1 (0.40) PTGS1PTGS2CXCR1CXCR2ALOX5
SCHEMBL10527841 0.78 ESR1 (0.39) FAAHPTGS1PTGS2CXCR1CXCR2
SCHEMBL10527007 0.77 EPHX1 (0.35) FAAHPTGS1PTGS2CXCR1CXCR2
SCHEMBL10485777 0.76 OPRM1 (0.43) PTGS1PTGS2CHRM1PDE4A
SCHEMBL10485707 0.75 OPRK1 (0.40) PTGS1PTGS2CXCR1CXCR2ALOX5
SCHEMBL10602088 0.74 FFAR1 (0.46) LMNABLMACHE

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-4883916-A ANTICHOLESTEROL, ANTIARTERIOSCELEROSIS EISAI CO., LTD. (JP) 1989-11-28 US disclosed
US-4788330-A Polyprenyl compounds EISAI CO., LTD. (JP) 1988-11-29 US disclosed