SCHEMBL4267061

SCHEMBL4267061

NC(=O)c1ccccc1OC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 3/20 0.59
CYP2C9 P11712 2/20 0.59
USP2 O75604 1/20 0.59
LMNA P02545 1/20 0.59
TBXA2R P21731 1/20 0.59
MAPK1 P28482 1/20 0.59
KMT2A Q03164 1/20 0.59
PTGS2 P35354 6/20 0.57
PTGS1 P23219 2/20 0.57
CXCL8 P10145 2/20 0.57
AKR1B10 O60218 1/20 0.57
UGT1A9 O60656 1/20 0.57
TRPA1 O75762 1/20 0.57
ABCB11 O95342 1/20 0.57
MT-CO2 P00403 1/20 0.57
ALB P02768 1/20 0.57
UGT1A6 P19224 1/20 0.57
UGT1A1 P22309 1/20 0.57
CXCR1 P25024 1/20 0.57
ADRA1A P35348 1/20 0.57

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
SCHEMBL8086145 0.88 TTR (0.67) TTRCYP2C9USP2LMNATBXA2R
SCHEMBL13318727 0.84 TTR (0.71) TTRCYP2C9USP2LMNATBXA2R
SCHEMBL2881532 0.81 TTR (0.59) TTRCYP2C9USP2LMNATBXA2R
SCHEMBL15542423 0.80 TTR (0.67) TTRCYP2C9USP2LMNATBXA2R
SCHEMBL13299191 0.80 TTR (0.70) TTRCYP2C9USP2LMNATBXA2R
SCHEMBL22434804 0.80 TTR (0.70) TTRCYP2C9USP2LMNATBXA2R
SCHEMBL6429068 0.79 TTR (0.76) TTRCYP2C9USP2LMNATBXA2R
SCHEMBL15849778 0.79 TTR (0.71) TTRCYP2C9USP2LMNATBXA2R
SCHEMBL30593463 0.79 TTR (0.71) TTRCYP2C9USP2LMNATBXA2R
SCHEMBL26655544 0.79 TTR (0.80) TTRCYP2C9USP2LMNATBXA2R

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2057139-A1 HYDROGEN SULFIDE DERIVATIVES OF NON-STEROIDAL ANTI-INFLAMMATORY DRUGS Antibe Therapeutics Inc. (US) 2009-05-13 EP disclosed
EP-2041108-A1 4-HYDROXYTHIOBENZAMIDE DERIVATIVES OF DRUGS Antibe Therapeutics Inc. (US) 2009-04-01 EP disclosed
WO-2008009118-A1 4-HYDROXYTHIOBENZAMIDE DERIVATIVES OF DRUGS ANTIBE THERAPEUTICS INC. (CA) 2008-01-24 WO disclosed
WO-2008009127-A1 HYDROGEN SULFIDE DERIVATIVES OF NON-STEROIDAL ANTI-INFLAMMATORY DRUGS ANTIBE THERAPEUTICS INC. (CA) 2008-01-24 WO disclosed