SCHEMBL13911458

SCHEMBL13911458

Cc1cccc(I)c1Nc1ccccc1CC(=O)OCCOS(C)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 7/20 0.50
▸ TTR P02766 2/20 0.44
▸ CYP2C9 P11712 2/20 0.44
▸ USP2 O75604 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ TBXA2R P21731 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CXCL8 P10145 2/20 0.38
▸ CLIC1 O00299 1/20 0.38
▸ CLCN2 P51788 1/20 0.38
▸ PTGS1 P23219 2/20 0.37
▸ AKR1B10 O60218 1/20 0.37
▸ UGT1A9 O60656 1/20 0.37
▸ TRPA1 O75762 1/20 0.37
▸ ABCB11 O95342 1/20 0.37
▸ MT-CO2 P00403 1/20 0.37
▸ ALB P02768 1/20 0.37
▸ UGT1A6 P19224 1/20 0.37
▸ UGT1A1 P22309 1/20 0.37

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
SCHEMBL13299190 0.84 TTR (0.64) PTGS2TTRCYP2C9USP2LMNA
SCHEMBL27637959 0.81 TTR (0.60) PTGS2TTRCYP2C9USP2LMNA
SCHEMBL25720185 0.76 PTGS2 (0.57) PTGS2TTRCYP2C9USP2LMNA
SCHEMBL11567028 0.74 PTGS2 (0.73) PTGS2TTRCYP2C9USP2LMNA
SCHEMBL11564032 0.71 PTGS2 (0.61) PTGS2TTRCYP2C9USP2LMNA
SCHEMBL13911457 0.71 TBXA2R (0.44) PTGS2LMNATBXA2RKMT2AGAA
SCHEMBL18878994 0.70 TTR (0.67) PTGS2TTRCYP2C9USP2LMNA
SCHEMBL10844751 0.69 TTR (0.70) PTGS2TTRCYP2C9USP2LMNA
SCHEMBL25719225 0.69 PTGS2 (0.57) PTGS2TTRCYP2C9USP2LMNA
SCHEMBL13089839 0.69 PTGS2 (0.60) PTGS2TTRCYP2C9USP2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009037707-A2 N-PHENYL ANTHRANILIC ACID DERIVATIVES AND USES THEREOF RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2009-03-26 — — WO disclosed
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