SCHEMBL7196758

SCHEMBL7196758

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
ALOX15 P16050 2/20 0.42
CYP3A4 P08684 1/20 0.39
KDM4E B2RXH2 5/20 0.38
HSD17B10 Q99714 4/20 0.38
HPGD P15428 4/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.37
USP2 O75604 1/20 0.36
TP53 P04637 1/20 0.36
AKR1C3 P42330 2/20 0.36
TSHR P16473 2/20 0.36
HMGB1 P09429 2/20 0.36
NAPRT Q6XQN6 2/20 0.36
ESR1 P03372 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
GGT1 P19440 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36

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
SCHEMBL29058304 0.84 ALDH1A1 (0.45) ALDH1A1ALOX15CYP3A4KDM4EHSD17B10
SCHEMBL28063877 0.84 ALDH1A1 (0.39) ALDH1A1ALOX15CYP3A4KDM4EHSD17B10
SCHEMBL10209980 0.84 ALDH1A1 (0.41) ALDH1A1ALOX15CYP3A4KDM4EHSD17B10
SCHEMBL27347857 0.82 CA12 (0.41) ALDH1A1KDM4EHPGDTSHRHMGB1
SCHEMBL27428623 0.82 ALDH1A1 (0.38) ALDH1A1ALOX15CYP3A4KDM4EHSD17B10
SCHEMBL867866 0.81 ALDH1A1 (0.48) ALDH1A1ALOX15CYP3A4KDM4EHSD17B10
SCHEMBL10208005 0.80 ALDH1A1 (0.47) ALDH1A1ALOX15CYP3A4HSD17B10KMT2A
SCHEMBL27710480 0.80 ALDH1A1 (0.44) ALDH1A1ALOX15CYP3A4KDM4EHSD17B10
Phthalic Acid SCHEMBL27989512 0.80 ALDH1A1 (0.44) ALDH1A1ALOX15KDM4EHSD17B10HPGD
SCHEMBL27614538 0.80 TSHR (0.39) ALDH1A1ALOX15CYP3A4KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1946795-B Dual-stage wafer applied underfills LORD CORP 2010-06-23 CN claimed
CN-103376682-A Toner for electrostatic image development KONICA MINOLTA INC 2013-10-30 CN disclosed
CN-1133696-C Novel thermoplastic elastomer composition with good oil resistance ������������ʽ���� 2004-01-07 CN disclosed
US-6590070-B1 Ethylene-glycidyl (meth)acrylate copolymer, a rosin having a carboxyl group, and a (meth)acrylate having a carboxyl group such as methacrylic acid; bonding electronic parts; capable of being cured using a low dose of radiation 3M INNOVATIVE PROPERTIES COMPANY 2003-07-08 US disclosed
EP-1088870-A1 Thermosetting adhesive composition and adhered structure 3M Innovative Properties Company (US) 2001-04-04 EP disclosed
CN-1218817-A Novel thermoplastic elastomer composition with good oil resistance ASAHI CHEMICAL IND (JP) 1999-06-09 CN disclosed