SCHEMBL1967796

SCHEMBL1967796

CCCc1ccc(-c2ccccc2CBr)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.41
FFAR4 Q5NUL3 5/20 0.41
PPARA Q07869 1/20 0.41
LTB4R2 Q9NPC1 1/20 0.41
PTGER1 P34995 1/20 0.39
PTGER4 P35408 1/20 0.39
PTGER3 P43115 1/20 0.39
PTGER2 P43116 1/20 0.39
MAOB P27338 2/20 0.39
ALOX5 P09917 1/20 0.38
DPP4 P27487 1/20 0.37
PDE10A Q9Y233 1/20 0.37
SIGMAR1 Q99720 1/20 0.36

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
SCHEMBL15238788 0.87 PPARA (0.50) FFAR1FFAR4PPARALTB4R2PTGER1
SCHEMBL1309773 0.83 ALDH1A1 (0.48) FFAR1FFAR4LTB4R2PTGER1PTGER4
SCHEMBL8029291 0.82 MAOB (0.47) MAOBALOX5
SCHEMBL28961512 0.80 DPP4 (0.48) PTGER1PTGER4PTGER3PTGER2DPP4
SCHEMBL1967799 0.79 CNR1 (0.41) ALOX5DPP4SIGMAR1
SCHEMBL29993202 0.79 HSD11B1 (0.47) FFAR1MAOBPDE10ASIGMAR1
SCHEMBL8121859 0.79 S1PR1 (0.42) PPARADPP4
SCHEMBL712947 0.77 HTR7 (0.44) FFAR1FFAR4DPP4
SCHEMBL28195006 0.77 FFAR1 (0.46) FFAR1FFAR4PPARALTB4R2PTGER1
SCHEMBL13818518 0.76 PPARA (0.51) FFAR1FFAR4PPARALTB4R2PTGER1

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-2334636-A2 HYDROXAMIC ACID DERIVATIVES USEFUL AS ANTIBACTERIAL AGENTS Pfizer Inc. (US) 2011-06-22 EP disclosed
WO-2010032147-A2 HYDROXAMIC ACID DERIVATIVES USEFUL AS ANTIBACTERIAL AGENTS PFIZER INC. (US) 2010-03-25 WO disclosed