SCHEMBL17425986

SCHEMBL17425986

O=C1C2Cc3ccccc3CC2C(=O)N1c1ccccc1N1C(=O)C2Cc3ccccc3CC2C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.54
▸ ALDH1A1 P00352 4/20 0.51
▸ HPGD P15428 2/20 0.51
▸ MAPT P10636 1/20 0.51
▸ PKM P14618 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ LMNA P02545 1/20 0.47
▸ AADAT Q8N5Z0 2/20 0.44
▸ GOT1 P17174 1/20 0.44
▸ KYAT1 Q16773 1/20 0.44
▸ KYAT3 Q6YP21 1/20 0.44
▸ HTT P42858 1/20 0.43
▸ TLR9 Q9NR96 1/20 0.41
▸ NOTUM Q6P988 2/20 0.41
▸ GAA P10253 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ PARP1 P09874 1/20 0.39
▸ MT-CO2 P00403 1/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ CYP1A2 P05177 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
SCHEMBL17425982 0.83 RAB9A (0.46) TSHRLMNAMT-CO2ALOX5KMT2A
SCHEMBL17425969 0.82 TSHR (0.43) TSHRALDH1A1HPGDMAPTPKM
SCHEMBL17432743 0.82 MEN1 (0.53) TSHRALDH1A1HPGDPKMTLR9
SCHEMBL17425973 0.79 ALDH1A1 (0.47) ALDH1A1HSD17B10GAAMT-CO2ALOX5
SCHEMBL18754564 0.77 ACHE (0.46) TSHRAADATGOT1KYAT1KYAT3
SCHEMBL17356841 0.75 ALDH1A1 (0.43) TSHRALDH1A1HPGDMAPTHSD17B10
SCHEMBL10905746 0.71 TSHR (0.67) TSHRALDH1A1HPGDMAPTPKM
SCHEMBL3884759 0.69 ALDH1A1 (0.67) TSHRALDH1A1HPGDMAPTGAA
SCHEMBL18938250 0.68 TSHR (0.37) TSHRALDH1A1HPGDMAPTPKM
SCHEMBL26590840 0.68 LMNA (0.45) TSHRALDH1A1HPGDMAPTPKM

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 5 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
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
Send feedback