SCHEMBL18754564

SCHEMBL18754564

CN1C(=O)C2Cc3ccccc3CC2C1=O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 0.46
▸ TSHR P16473 2/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ ANPEP P15144 1/20 0.38
▸ AADAT Q8N5Z0 2/20 0.38
▸ GOT1 P17174 1/20 0.38
▸ KYAT1 Q16773 1/20 0.38
▸ KYAT3 Q6YP21 1/20 0.38
▸ SRD5A1 P18405 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
SCHEMBL17356841 0.77 ALDH1A1 (0.43) ACHETSHRKMT2AANPEP
SCHEMBL17425982 0.77 RAB9A (0.46) TSHRKMT2A
SCHEMBL17425986 0.77 TSHR (0.54) TSHRKMT2AAADATGOT1KYAT1
SCHEMBL17432743 0.75 MEN1 (0.53) ACHETSHRKMT2A
SCHEMBL5094308 0.74 RAB9A (0.44) TSHRKMT2A
SCHEMBL18938250 0.74 TSHR (0.37) ACHETSHRKMT2AAADAT
SCHEMBL17425973 0.72 ALDH1A1 (0.47) KMT2A
SCHEMBL3884759 0.71 ALDH1A1 (0.67) ACHETSHRKMT2A
SCHEMBL22045856 0.69 KMT2A (0.47) TSHRKMT2A
SCHEMBL19711770 0.69 KMT2A (0.47) TSHRKMT2A

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 2 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
EP-2965907-B1 OXYGEN-ABSORBING MEDICAL MULTIWALL CONTAINER AND BIOPHARMACEUTICAL STORAGE METHOD MITSUBISHI GAS CHEMICAL CO (JP) 2017-04-19 — — EP disclosed
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