SCHEMBL17356841

SCHEMBL17356841

O=C1C2Cc3ccccc3CC2C(=O)N1CN1C(=O)C2Cc3ccccc3CC2C1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.43
▸ CASP1 P29466 2/20 0.43
▸ CASP7 P55210 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ NPY1R P25929 1/20 0.43
▸ NPY2R P49146 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ ADORA2A P29274 1/20 0.41
▸ ALOX12 P18054 1/20 0.40
▸ SIGMAR1 Q99720 2/20 0.39
▸ MT-CO2 P00403 1/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ TGM2 P21980 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL3884759 0.81 ALDH1A1 (0.67) ALDH1A1CASP1CASP7TSHRMEN1
SCHEMBL18754564 0.77 ACHE (0.46) TSHRKMT2AACHEANPEP
SCHEMBL17425982 0.75 RAB9A (0.46) TSHRMEN1KMT2AMT-CO2ALOX5
SCHEMBL17425986 0.75 TSHR (0.54) ALDH1A1TSHRMAPTHPGDKMT2A
SCHEMBL17432743 0.73 MEN1 (0.53) ALDH1A1TSHRMEN1HPGDKMT2A
SCHEMBL18938250 0.72 TSHR (0.37) ALDH1A1CASP1CASP7TSHRMEN1
SCHEMBL17425973 0.71 ALDH1A1 (0.47) ALDH1A1CASP1CASP7MEN1KMT2A
SCHEMBL17432744 0.67 BRD4 (0.41) CASP7TSHRACHEANPEP
SCHEMBL10738466 0.67 ANPEP (0.41) ACHEANPEP
SCHEMBL10738472 0.67 ANPEP (0.41) ACHEANPEP

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-10035640-B2 Oxygen-absorbing multilayer body, oxygen-absorbing container, oxygen-absorbing airtight container, oxygen-absorbing push-through pack, and storage method using same MITSUBISHI HAS CHEMICAL COMPANY, INC. (JP) 2018-07-31 — — US disclosed
US-9994382-B2 Oxygen-absorbing medical multilayer container and method for storing biological medicine MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2018-06-12 — — 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-20150368022-A1 OXYGEN-ABSORBING MULTILAYER BODY, OXYGEN-ABSORBING CONTAINER, OXYGEN-ABSORBING AIRTIGHT CONTAINER, OXYGEN-ABSORBING PUSH-THROUGH PACK, AND STORAGE METHOD USING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2015-12-24 — — US disclosed
US-20150368023-A1 OXYGEN-ABSORBING MEDICAL MULTILAYER CONTAINER AND METHOD FOR STORING BIOLOGICAL MEDICINE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2015-12-24 — — US disclosed
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