SCHEMBL5541003

SCHEMBL5541003

O=C(O)c1ccc2cc(C(=O)O)c(O)cc2c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.53
PTPN11 Q06124 1/20 0.53
CA12 O43570 3/20 0.50
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA7 P43166 3/20 0.50
CA9 Q16790 3/20 0.50
CA14 Q9ULX7 3/20 0.50
KDM4E B2RXH2 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
PTGS2 P35354 2/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
GRIN2D O15399 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIN2B Q13224 1/20 0.49
GRIN2C Q14957 1/20 0.49

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
SCHEMBL30570062 1.00 LCK (0.53) LCKPTPN11CA12CA1CA2
SCHEMBL1165653 1.00 LCK (0.53) LCKPTPN11CA12CA1CA2
SCHEMBL29812614 1.00 LCK (0.53) LCKPTPN11CA12CA1CA2
Hydrochloric Acid SCHEMBL3924510 0.98 LCK (0.52) LCKPTPN11CA12CA1CA2
Potassium SCHEMBL7182313 0.98 LCK (0.52) LCKPTPN11CA12CA1CA2
SCHEMBL7182303 0.98 LCK (0.52) LCKPTPN11CA12CA1CA2
SCHEMBL3391297 0.88 LCK (0.67) LCKPTPN11CA12CA1CA2
SCHEMBL464946 0.88 KDM4E (0.57) LCKPTPN11CA12CA1CA2
SCHEMBL29729046 0.88 KDM4E (0.57) LCKPTPN11CA12CA1CA2
SCHEMBL29779941 0.88 LCK (0.67) LCKPTPN11CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7179401-B2 Thermotropic liquid-crystalline polymer KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 2007-02-20 US disclosed
EP-1422256-B1 THERMOTROPIC LIQUID-CRYSTAL POLYMER UENO SEIYAKU OYO KENKYUJO KK (JP) 2006-08-02 EP disclosed
US-20040256599-A1 Thermotorpic liquid-crystal polymer UENO FINE CHEMICALS INDUSTRY, LTD. (JP) 2004-12-23 US disclosed
EP-1422256-A1 THERMOTROPIC LIQUID-CRYSTAL POLYMER Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 2004-05-26 EP disclosed
EP-0539243-B1 Process for introducing a carboxyl group to an aromatic carboxylic acid or a derivative thereof HIRAI HIDEFUMI (JP) 1996-01-24 EP disclosed
US-5319134-A Process for introducing a carboxyl group to an aromatic carboxylic acid or a derivative thereof HIDEFUMI HIRAI (JP) 1994-06-07 US disclosed
EP-0539243-A2 Process for introducing a carboxyl group to an aromatic carboxylic acid or a derivative thereof Hirai, Hidefumi (JP) 1993-04-28 EP disclosed