SCHEMBL13257558

SCHEMBL13257558

CC(C)CC(=O)c1ccccc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
ALOX15 P16050 1/20 0.56
USP2 O75604 1/20 0.47
TP53 P04637 1/20 0.47
MYC P01106 3/20 0.47
NR4A1 P22736 1/20 0.47
MAPT P10636 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
AKR1C3 P42330 2/20 0.45
TSHR P16473 2/20 0.44
KDM4E B2RXH2 2/20 0.44
HMGB1 P09429 2/20 0.44
HPGD P15428 2/20 0.44
NAPRT Q6XQN6 2/20 0.44
ESR1 P03372 1/20 0.44
ITGB3 P05106 1/20 0.44
ITGA2B P08514 1/20 0.44
GGT1 P19440 1/20 0.44
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44

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
Phthalic Acid SCHEMBL27498269 0.86 ALDH1A1 (0.58) ALDH1A1ALOX15MYCNR4A1MAPT
SCHEMBL8635130 0.84 ALDH1A1 (0.44) ALDH1A1TSHRKDM4EHPGDTDP1
SCHEMBL7712754 0.83 KDM4E (0.52) ALDH1A1KDM4EHMGB1HPGDHSD17B10
SCHEMBL10872467 0.82 ALDH1A1 (0.43) ALDH1A1ALOX15MAPTTSHRHPGD
Phthalic Acid SCHEMBL28036104 0.81 ALDH1A1 (0.64) ALDH1A1ALOX15MYCNR4A1MAPT
Phthalic Acid SCHEMBL28006650 0.81 ALDH1A1 (0.70) ALDH1A1ALOX15MYCNR4A1MAPT
Phthalic Acid SCHEMBL28418540 0.80 ALDH1A1 (0.78) ALDH1A1ALOX15MYCNR4A1MAPT
SCHEMBL27925176 0.80 FFAR1 (0.48) ALDH1A1MAPTTSHRKDM4EHMGB1
SCHEMBL13647199 0.80 ERCC5 (0.55) ALDH1A1TSHRHPGDGRM2
SCHEMBL11650545 0.78 ERCC5 (0.53) ALDH1A1TP53MAPTKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8937112-B2 Concentrated fluoropolymer dispersions stabilized with anionic polyelectrolyte dispersing agents E I DU PONT DE NEMOURS AND COMPANY (US) 2015-01-20 US disclosed
US-7754287-B2 Process for forming filled bearings from fluoropolymer dispersions stabilized with anionic polyelectrolyte dispersing agents E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-13 US disclosed
US-20070281101-A1 Process for forming filled bearings from fluoropolymer dispersions stabilized with anionic polyelectrolyte dispersing agents THE CHEMOURS COMPANY FC, LLC 2007-12-06 US disclosed
US-20070282044-A1 Concentrated fluoropolymer dispersions stabilized with anionic polyelectrolyte dispersing agents E. I. DU PONT DE NEMOURS AND COMPANY 2007-12-06 US disclosed
US-7294276-B2 Process for preparing fluoropolymer dispersions SOLVAY SOLEXIS S.P.A. (IT) 2007-11-13 US disclosed