SCHEMBL5657033

SCHEMBL5657033

O=C(O)c1nc(O)ccc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
MAPT P10636 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 6/20 0.38
CA1 P00915 5/20 0.38
CA2 P00918 5/20 0.38
CA12 O43570 4/20 0.38
CA7 P43166 4/20 0.38
CA9 Q16790 4/20 0.38
CA14 Q9ULX7 4/20 0.38
PTGS2 P35354 3/20 0.38
CA4 P22748 2/20 0.38
CA6 P23280 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
SELL P14151 1/20 0.38
SELP P16109 1/20 0.38
ALOX5 P09917 1/20 0.37
CYP2C9 P11712 2/20 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
SCHEMBL31645569 0.79 ALDH1A1 (0.41) ALDH1A1MAPTSMN1; SMN2KDM4ECA1
SCHEMBL1520617 0.79 ALDH1A1 (0.47) ALDH1A1MAPTSMN1; SMN2KDM4ECA1
SCHEMBL14458093 0.79 THRB (0.38) ALDH1A1MAPTSMN1; SMN2KDM4ECA9
SCHEMBL595464 0.79 ALDH1A1 (0.41) ALDH1A1MAPTSMN1; SMN2KDM4ECA1
SCHEMBL8834235 0.79 KDM4E (0.50) ALDH1A1MAPTSMN1; SMN2KDM4ECA1
SCHEMBL29621628 0.79 ALDH1A1 (0.47) ALDH1A1MAPTSMN1; SMN2KDM4ECA1
SCHEMBL31646044 0.77 ALDH1A1 (0.44) ALDH1A1MAPTSMN1; SMN2KDM4ECA1
SCHEMBL31193135 0.77 ALDH1A1 (0.40) ALDH1A1MAPTSMN1; SMN2KDM4ECA1
SCHEMBL1759159 0.77 GRM5 (0.53) ALDH1A1MAPTSMN1; SMN2KDM4ECA1
SCHEMBL1186851 0.77 GABRP (0.47) ALDH1A1MAPTSMN1; SMN2KDM4ECA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7250389-B1 Antifungal compound and process for producing the same MEIJI SEIKA KAISHA, LTD. (JP) 2007-07-31 US disclosed
EP-1054011-B1 NOVEL ANTIFUNGAL COMPOUNDS AND PROCESS FOR PRODUCING THE SAME MEIJI SEIKA KAISHA (JP) 2006-09-13 EP disclosed
EP-1054011-A1 NOVEL ANTIFUNGAL COMPOUNDS AND PROCESS FOR PRODUCING THE SAME MEIJI SEIKA KAISHA LTD. (JP) 2000-11-22 EP disclosed
EP-0504818-B1 Microbiological process for the preparation of 6-hydroxy picolinic acid LONZA AG (CH) 1997-07-16 EP disclosed
EP-0498316-B1 Microbiological process for the production of 6-hydroxypicolinic acid LONZA AG (CH) 1995-09-06 EP disclosed
US-5270203-A Biologically pure culture of Alcaligenes faecalis DSM 6335 LONZA LTD. (CH) 1993-12-14 US disclosed
US-5268294-A Mutants LONZA LTD. (CH) 1993-12-07 US disclosed
US-5264361-A Biosynthesis, alcalgenes LONZA LTD. (CH) 1993-11-23 US disclosed
US-5238830-A Cultivating aerobic biomass with picolinic acid or soluble salt and mineral acid, hydroxylating with biomass LONZA LTD. (CH) 1993-08-24 US disclosed
US-5182197-A Alcaligenes LONZA LTD. (CH) 1993-01-26 US disclosed
EP-0504818-A2 Microbiological process for the preparation of 6-hydroxy picolinic acid LONZA AG (CH) 1992-09-23 EP disclosed
EP-0498316-A1 Microbiological process for the production of 6-hydroxypicolinic acid LONZA AG (CH) 1992-08-12 EP disclosed