SCHEMBL11389207

SCHEMBL11389207

COc1cc2ncc(C(=O)O)c(=O)n2c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.46
▸ PTPN1 P18031 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.42
▸ GAA P10253 2/20 0.42
▸ PKM P14618 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ HPGD P15428 2/20 0.40
▸ PDE10A Q9Y233 1/20 0.39
▸ FABP4 P15090 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL11695938 0.88 KDM4E (0.44) KDM4EALDH1A1GAAPKMHPGD
SCHEMBL11388659 0.85 MEN1 (0.54) KDM4EALDH1A1GAAHPGD
SCHEMBL11662464 0.83 MEN1 (0.43) KDM4EPTPN1ALDH1A1GAAHPGD
SCHEMBL11625309 0.82 KDM4E (0.50) KDM4EALDH1A1GAAPKMHPGD
SCHEMBL11697872 0.82 ALDH1A1 (0.44) KDM4EALDH1A1GAAHPGDCYP1A2
SCHEMBL11679136 0.79 ALDH1A1 (0.39) KDM4EPTPN1ALDH1A1HPGDCYP1A2
SCHEMBL11624395 0.77 MEN1 (0.55) KDM4EALDH1A1GAAHPGDCYP1A2
SCHEMBL11798802 0.75 KDM4E (0.44) KDM4EPTPN1ALDH1A1GAAPKM
SCHEMBL10779059 0.72 KDM4E (0.53) KDM4EALDH1A1GAAPKMALOX15
SCHEMBL11626130 0.72 KDM4E (0.48) KDM4EALDH1A1GAAHPGDCYP1A2

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
US-4247699-A REACTION OF AN ISATOIC ANHYDRIDE WITH MALONONITRILE FOLLOWED BY TREATMENT WITH A STRONG ACID OR BASE PFIZER INC. (US) 1981-01-27 — — US disclosed
US-4175193-A INTERMEDIATES FOR 1-OXO-1H-6-ALKOXYPYRIMDO(1,2-A)QUINOLINE-2-CARBOXYLIC ACID AND ESTER ANTIALLERGENS PFIZER INC. (US) 1979-11-20 — — US disclosed
US-4066766-A 1-Oxo-6-substituted pyrimido [1,2-a]quinoline-2-carboxylic acids and derivatives thereof and their use as antiallergy agents PFIZER INC. (US) 1978-01-03 — — US disclosed
US-4031217-A PYRIMIDINE-QUINOLINE COMPOUNDS PFIZER INC. (US) 1977-06-21 — — US disclosed
US-4017625-A Anti-allergic N-(5-tetrazolyl)-1-oxo-1H-6-alkoxypyrimido-[1,2-a]quinoline-2-carboxamides and intermediates therefor PFIZER INC. (US) 1977-04-12 — — US disclosed
US-4014881-A ANTIULCER AGENTS PFIZER INC. (US) 1977-03-29 — — US disclosed
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