SCHEMBL17425973

SCHEMBL17425973

O=C1C2Cc3ccccc3CC2C(=O)N1c1cccc(N2C(=O)C3Cc4ccccc4CC3C2=O)c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.47
▸ CASP1 P29466 1/20 0.47
▸ CASP7 P55210 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ APEX1 P27695 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ CTDSP1 Q9GZU7 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ FAAH O00519 1/20 0.44
▸ MGLL Q99685 1/20 0.44
▸ GAA P10253 2/20 0.43
▸ MT-CO2 P00403 2/20 0.43
▸ ALOX5 P09917 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42

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
SCHEMBL17432743 0.89 MEN1 (0.53) ALDH1A1POLBGAAMT-CO2ALOX5
SCHEMBL17425982 0.86 RAB9A (0.46) POLBMT-CO2ALOX5MEN1KMT2A
SCHEMBL17425953 0.84 ALDH1A1 (0.42) ALDH1A1CASP1CASP7HSD17B10L3MBTL1
SCHEMBL17425986 0.79 TSHR (0.54) ALDH1A1HSD17B10GAAMT-CO2ALOX5
SCHEMBL17532456 0.77 ALDH1A1 (0.60) ALDH1A1L3MBTL1TDP1FAAHMGLL
SCHEMBL11174001 0.74 L3MBTL1 (0.46) ALDH1A1CASP1CASP7HSD17B10L3MBTL1
SCHEMBL17430455 0.74 MT-CO2 (0.43) ALDH1A1GAAMT-CO2ALOX5SMN1; SMN2
SCHEMBL10899845 0.73 MGLL (0.54) ALDH1A1CASP1CASP7HSD17B10L3MBTL1
SCHEMBL18754564 0.72 ACHE (0.46) KMT2A
SCHEMBL10904126 0.72 TSHR (0.60) ALDH1A1HSD17B10POLBMT-CO2ALOX5

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
EP-2965809-B1 OXYGEN ABSORBER COMPOSITION, AND MOLDED BODY AND PACKAGE EACH USING SAME MITSUBISHI GAS CHEMICAL CO (JP) 2017-06-07 — — EP disclosed
US-9670408-B2 Oxygen absorbent composition and molded body and package using the same MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2017-06-06 — — US disclosed
US-9670408-B2 Oxygen absorbent composition and molded body and package using the same MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2017-06-06 — — US disclosed
US-20160009993-A1 OXYGEN ABSORBENT COMPOSITION AND MOLDED BODY AND PACKAGE USING THE SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2016-01-14 — — US disclosed
US-20160009993-A1 OXYGEN ABSORBENT COMPOSITION AND MOLDED BODY AND PACKAGE USING THE SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2016-01-14 — — US disclosed
EP-2965809-A1 OXYGEN ABSORBER COMPOSITION, AND MOLDED BODY AND PACKAGE EACH USING SAME Mitsubishi Gas Chemical Company, Inc. (JP) 2016-01-13 — — EP disclosed
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