SCHEMBL8480965

SCHEMBL8480965

CC(=O)Cc1ccc2c(c1)cc(C(=O)OCc1ccccc1)n2Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 3/20 0.49
F10 P00742 3/20 0.47
NOD2 Q9HC29 1/20 0.46
NOD1 Q9Y239 1/20 0.46
PLA2G2A P14555 1/20 0.46
AR P10275 3/20 0.43
RAB9A P51151 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
F2 P00734 1/20 0.43
HTT P42858 1/20 0.43
SRC P12931 1/20 0.42
TBXA2R P21731 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
SCHEMBL8484720 0.88 NOD2 (0.54) CCR2F10NOD2NOD1AR
SCHEMBL8483705 0.87 CCR2 (0.51) CCR2F10NOD2NOD1PLA2G2A
SCHEMBL17060318 0.81 NOD2 (0.60) CCR2F10NOD2NOD1PLA2G2A
SCHEMBL5424592 0.78 NOD2 (0.75) CCR2F10NOD2NOD1AR
SCHEMBL8602230 0.78 ADRB3 (0.45) CCR2F10
SCHEMBL8602233 0.78 ADRB3 (0.45) CCR2F10
SCHEMBL18746289 0.78 CCR2 (0.54) CCR2F10NOD2NOD1PLA2G2A
SCHEMBL8603639 0.77 CCR2 (0.39) CCR2F10NOD2NOD1PLA2G2A
SCHEMBL8603638 0.77 CCR2 (0.39) CCR2F10NOD2NOD1PLA2G2A
SCHEMBL17060361 0.76 CCR2 (0.57) CCR2F10NOD2NOD1PLA2G2A

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-5859044-A TREATING DIABETES, HYPERGLYCEMIA, OBESITY; INCREASING CONTENT OF LEAN MEAT IN ANIMALS PFIZER INC. (US) 1999-01-12 US disclosed
EP-0822185-A1 B-3-adrenergic agonists as antidiabetic and antiobesity agents PFIZER INC. (US) 1998-02-04 EP disclosed