SCHEMBL7724203

SCHEMBL7724203

C=Cc1ccc(CC(C(=O)O)(C(=O)O)C(C)(C)CCc2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
PPARA Q07869 3/20 0.37
PPARG P37231 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
HIF1A Q16665 1/20 0.36
MMP8 P22894 2/20 0.36
SLC13A5 Q86YT5 3/20 0.35
TP53 P04637 1/20 0.35
PSMD14 O00487 1/20 0.34
LMNA P02545 1/20 0.34
FFAR1 O14842 1/20 0.34
TRPA1 O75762 1/20 0.34
POLB P06746 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL5142183 0.80 THRA (0.46) ALDH1A1CYP3A4CYP2C9CYP2C19THRA
SCHEMBL5144190 0.77 MMP8 (0.38) ALDH1A1CYP3A4CYP2C9CYP2C19PPARA
SCHEMBL7724200 0.71 ALDH1A1 (0.42) ALDH1A1CYP3A4CYP2C9CYP2C19THRA
SCHEMBL9806380 0.71 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2FFAR1POLB
SCHEMBL5142208 0.70 MMP8 (0.41) ALDH1A1CYP3A4CYP2C9CYP2C19THRA
SCHEMBL7723920 0.70 ALDH1A1 (0.41) ALDH1A1CYP3A4CYP2C9CYP2C19THRA
SCHEMBL22113055 0.70 ALDH1A1 (0.42) ALDH1A1THRATHRBPPARASLC13A5
SCHEMBL5144294 0.70 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2SLC13A5FFAR1POLB
SCHEMBL7708969 0.70 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2SLC13A5FFAR1POLB
SCHEMBL5033468 0.69 ALDH1A1 (0.46) ALDH1A1THRATHRBPPARASLC13A5

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
US-6399273-B1 Water-processable photoresist compositions BOARD OF REGENTS, UNIVERSITY OF TEXAS SYSTEM 2002-06-04 US disclosed