SCHEMBL8896685

SCHEMBL8896685

CCCCCCCCCCCCCCCCC(C(N)=O)c1ccccc1C(CCCCCCCCCCCCCCCC)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.44
CYSLTR1 Q9Y271 2/20 0.44
LMNA P02545 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP13 P45452 1/20 0.43
CSNK1E P49674 1/20 0.42
GPR84 Q9NQS5 3/20 0.42
FFAR1 O14842 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CNR2 P34972 1/20 0.41
MAPT P10636 1/20 0.41
LCK P06239 1/20 0.41
PPARD Q03181 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
PPARG P37231 2/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 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
SCHEMBL9620287 0.86 PPARG (0.49) CYSLTR2CYSLTR1CSNK1EGPR84FFAR1
SCHEMBL8666771 0.86 PPARG (0.49) CYSLTR2CYSLTR1CSNK1EGPR84FFAR1
SCHEMBL28419027 0.85 ALDH1A1 (0.44) CYSLTR2CYSLTR1LMNACSNK1EGPR84
SCHEMBL3664377 0.85 ALDH1A1 (0.44) CYSLTR2CYSLTR1LMNACSNK1EGPR84
SCHEMBL28419011 0.85 ALDH1A1 (0.44) CYSLTR2CYSLTR1LMNACSNK1EGPR84
SCHEMBL3664559 0.85 ALDH1A1 (0.44) CYSLTR2CYSLTR1LMNACSNK1EGPR84
SCHEMBL5135540 0.85 MEN1 (0.43) CYSLTR2CYSLTR1LMNAMMP9MMP8
SCHEMBL28416201 0.85 ALDH1A1 (0.44) CYSLTR2CYSLTR1LMNACSNK1EGPR84
SCHEMBL16586532 0.83 ALDH1A1 (0.42) CYSLTR2CYSLTR1CSNK1EGPR84FFAR1
SCHEMBL8663792 0.83 BID (0.47) CYSLTR2CYSLTR1GPR84FFAR1ALDH1A1

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-0568309-B1 Resin composition for electrophotographic toner MITSUI TOATSU CHEMICALS (JP) 1997-07-16 EP disclosed
US-5502110-A ADDITION POLYMER BLENDS PREPARED WITH MULTIFUNCTIONAL PEROXIDE INITIATORS MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1996-03-26 US disclosed
EP-0568309-A2 Resin composition for electrophotographic toner MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-11-03 EP disclosed