SCHEMBL7721665

SCHEMBL7721665

Cc1ccc(-n2c(-c3ccccc3)nc3ccc(Oc4ccc(OCCCC(=O)O)cc4)cc32)cc1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 5/20 0.59
FFAR1 O14842 3/20 0.52
PIN1 Q13526 1/20 0.46
AR P10275 1/20 0.45
SIRT2 Q8IXJ6 1/20 0.45
SIRT1 Q96EB6 1/20 0.45
CHEK2 O96017 1/20 0.44
PPARG P37231 2/20 0.44
ESRRA P11474 1/20 0.43
KCNH2 Q12809 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
LTA4H P09960 1/20 0.43
FABP4 P15090 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PPARA Q07869 1/20 0.42
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42
P2RY12 Q9H244 1/20 0.42
LTB4R Q15722 1/20 0.42

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
SCHEMBL7717779 0.94 FFAR4 (0.57) FFAR4FFAR1PIN1SIRT2SIRT1
SCHEMBL2327149 0.92 FFAR4 (0.48) FFAR4FFAR1PIN1ARSIRT2
SCHEMBL2327181 0.90 PPARG (0.52) FFAR4ARSIRT2SIRT1PPARG
SCHEMBL9281680 0.88 PDE3B (0.47) FFAR4FFAR1SIRT2SIRT1PPARG
SCHEMBL2332168 0.86 FFAR4 (0.47) FFAR4FFAR1PIN1SIRT2SIRT1
SCHEMBL2329776 0.86 SIRT2 (0.51) FFAR4ARSIRT2SIRT1PPARG
SCHEMBL2211572 0.85 G6PD (0.46) FFAR4PPARGHRH3PPARAPDE3B
SCHEMBL9281733 0.85 PDE3B (0.47) PPARGFABP4PPARAPDE3BPDE3A
SCHEMBL4588629 0.85 FAAH (0.47) ARSIRT2SIRT1CHEK2PPARG
SCHEMBL4590119 0.84 LTB4R (0.48) FFAR4FFAR1PPARGPPARAPDE3B

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
EP-1246808-A1 1,2-DIARYL BENZIMIDAZOLES FOR TREATING ILLNESSES ASSOCIATED WITH A MICROGLIA ACTIVATION SCHERING AKTIENGESELLSCHAFT (DE) 2002-10-09 EP disclosed
WO-2001051473-A1 1,2-DIARYL BENZIMIDAZOLES FOR TREATING ILLNESSES ASSOCIATED WITH A MICROGLIA ACTIVATION SCHERING AKTIENGESELLSCHAFT (DE) 2001-07-19 WO disclosed