SCHEMBL11168770

SCHEMBL11168770

O=C(O)c1n[nH]c(=O)c2cc(Cl)c(Cl)cc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.45
▸ GRIN2D O15399 1/20 0.45
▸ GRIN3B O60391 1/20 0.45
▸ GRIK1 P39086 1/20 0.45
▸ GRIA1 P42261 1/20 0.45
▸ GRIA2 P42262 1/20 0.45
▸ GRIA3 P42263 1/20 0.45
▸ GRIA4 P48058 1/20 0.45
▸ GRIN1 Q05586 1/20 0.45
▸ GRIN2A Q12879 1/20 0.45
▸ GRIK2 Q13002 1/20 0.45
▸ GRIK3 Q13003 1/20 0.45
▸ GRIN2B Q13224 1/20 0.45
▸ GRIN2C Q14957 1/20 0.45
▸ GRIK4 Q16099 1/20 0.45
▸ GRIK5 Q16478 1/20 0.45
▸ GRIN3A Q8TCU5 1/20 0.45
▸ PRKAB2 O43741 16/20 0.43
▸ PRKAG1 P54619 16/20 0.43
▸ PRKAA2 P54646 16/20 0.43

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
SCHEMBL11158785 0.81 KMT2A (0.45) LMNAPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL11170521 0.81 ROCK1 (0.46) LMNAPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL4782757 0.80 PRKAB2 (0.61) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL14915843 0.78 PRKAG1 (0.46) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL10508693 0.76 PARP1 (0.48) LMNAPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL23098990 0.75 ALDH1A1 (0.49) LMNAPRKAA1KDM4EHTT
SCHEMBL11165259 0.75 MAP2K4 (0.44) HCAR2KDM4EMAPK1
SCHEMBL29735258 0.75 ALDH1A1 (0.49) LMNAPRKAA1KDM4EHTT
SCHEMBL27385009 0.75 ALDH1A1 (0.49) LMNAPRKAA1KDM4EHTT
SCHEMBL27384820 0.75 POLB (0.46) PRKAG1PRKAA1PRKAB1KDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4393062-A ALDOSE REDUCTASE INHIBITOR IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-07-12 — — US disclosed
EP-0002895-B1 ENZYME INHIBITORY PHTHALAZIN-4-YLACETIC ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND PROCESS FOR THEIR MANUFACTURE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-10-14 — — EP disclosed
US-4251528-A ALDOSE REDUCTASE INHIBITORS USEFUL IN DIABETES, GALACTOSEMIA IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-02-17 — — US disclosed
EP-0002895-A1 Enzyme inhibitory phthalazin-4-ylacetic acid derivatives, pharmaceutical compositions thereof, and process for their manufacture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1979-07-11 — — EP disclosed
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