SCHEMBL17425982

SCHEMBL17425982

O=C1C2Cc3ccccc3CC2C(=O)N1c1ccc(N2C(=O)C3Cc4ccccc4CC3C2=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.46
▸ MT-CO2 P00403 4/20 0.46
▸ ALOX5 P09917 4/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ TSHR P16473 2/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ ATM Q13315 1/20 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
SCHEMBL17432743 0.94 MEN1 (0.53) MT-CO2ALOX5MEN1KMT2ATSHR
SCHEMBL17425973 0.86 ALDH1A1 (0.47) MT-CO2ALOX5MEN1KMT2APOLB
SCHEMBL17425986 0.83 TSHR (0.54) MT-CO2ALOX5KMT2ATSHRLMNA
SCHEMBL17430455 0.82 MT-CO2 (0.43) RAB9AMT-CO2ALOX5MEN1KMT2A
SCHEMBL18754564 0.77 ACHE (0.46) KMT2ATSHR
SCHEMBL10904126 0.76 TSHR (0.60) MT-CO2ALOX5MEN1KMT2ATSHR
SCHEMBL17356841 0.75 ALDH1A1 (0.43) MT-CO2ALOX5MEN1KMT2ATSHR
SCHEMBL26590830 0.74 MEN1 (0.59) MT-CO2ALOX5MEN1KMT2ATSHR
SCHEMBL17425953 0.73 ALDH1A1 (0.42) MT-CO2ALOX5MEN1KMT2ATSHR
SCHEMBL10904294 0.72 ALDH1A1 (0.54) TSHRLMNAPOLB

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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