SCHEMBL7754498

SCHEMBL7754498

CCCCC(C(=O)OCC(=O)O)c1ccccc1Nc1c(Cl)cccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL8 P10145 8/20 0.55
TTR P02766 3/20 0.53
CYP2C9 P11712 2/20 0.53
USP2 O75604 1/20 0.53
LMNA P02545 1/20 0.53
TBXA2R P21731 1/20 0.53
MAPK1 P28482 1/20 0.53
KMT2A Q03164 1/20 0.53
PTGS2 P35354 5/20 0.45
PTGS1 P23219 2/20 0.45
AKR1B10 O60218 1/20 0.45
UGT1A9 O60656 1/20 0.45
TRPA1 O75762 1/20 0.45
ABCB11 O95342 1/20 0.45
MT-CO2 P00403 1/20 0.45
ALB P02768 1/20 0.45
UGT1A6 P19224 1/20 0.45
UGT1A1 P22309 1/20 0.45
CXCR1 P25024 1/20 0.45
ADRA1A P35348 1/20 0.45

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
SCHEMBL8370142 0.83 TTR (0.56) CXCL8TTRCYP2C9USP2LMNA
SCHEMBL9008056 0.83 TTR (0.47) CXCL8TTRCYP2C9USP2LMNA
SCHEMBL8370034 0.82 TTR (0.55) CXCL8TTRCYP2C9USP2LMNA
SCHEMBL8370141 0.78 TTR (0.55) CXCL8TTRCYP2C9USP2LMNA
SCHEMBL13186033 0.76 CXCL8 (0.68) CXCL8TTRCYP2C9USP2LMNA
SCHEMBL8370030 0.75 TTR (0.54) CXCL8TTRCYP2C9USP2LMNA
SCHEMBL5974909 0.75 CXCL8 (0.59) CXCL8TTRCYP2C9USP2LMNA
SCHEMBL10651453 0.74 CXCL8 (0.62) CXCL8TTRCYP2C9USP2LMNA
SCHEMBL8371914 0.73 CXCL8 (0.51) CXCL8TTRCYP2C9USP2LMNA
SCHEMBL11852028 0.73 CASP1 (0.45) KMT2ACYP3A4GAA

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-1082290-A1 PROCESS FOR THE PREPARATION OF ACECLOFENAC RUSSINSKY LIMITED (IE) 2001-03-14 EP disclosed
WO-1999055660-A1 PROCESS FOR THE PREPARATION OF ACECLOFENAC RUSSINSKY LIMITED (IE) 1999-11-04 WO disclosed