SCHEMBL31037047

SCHEMBL31037047

COc1nn(-c2ccccc2)c2c1C(=O)C(=O)c1cc([N+](=O)[O-])ccc1-2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPRC P08575 3/20 0.47
▸ S100A4 P26447 2/20 0.47
▸ BCHE P06276 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ CES1 P23141 1/20 0.47
▸ ABHD16A O95870 1/20 0.42
▸ NPC1 O15118 3/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ PTGS2 P35354 3/20 0.40
▸ CA9 Q16790 2/20 0.40
▸ PAX8 Q06710 1/20 0.40
▸ CA12 O43570 1/20 0.39
▸ MAPT P10636 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ IDO1 P14902 3/20 0.39
▸ TDO2 P48775 3/20 0.39
▸ POLB P06746 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
SCHEMBL25975644 1.00 PTPRC (0.47) PTPRCS100A4BCHEACHECES1
SCHEMBL31037045 0.82 HIF1A (0.54) NPC1RAB9APAX8MAPTSMN1; SMN2
SCHEMBL25975633 0.82 HIF1A (0.54) NPC1RAB9APAX8MAPTSMN1; SMN2
SCHEMBL22733091 0.82 NPC1 (0.43) PTPRCABHD16ANPC1RAB9APAX8
SCHEMBL22733034 0.82 NPC1 (0.43) PTPRCS100A4NPC1RAB9ACA9
SCHEMBL22733085 0.82 NPC1 (0.43) PTPRCS100A4NPC1RAB9ACA9
SCHEMBL2551285 0.74 KHK (0.52) ACHEABHD16APTGS2CA9CA12
SCHEMBL25975640 0.74 HIF1A (0.49) NPC1RAB9APAX8MAPTSMN1; SMN2
SCHEMBL22733090 0.73 IDO1 (0.47) ABHD16ANPC1RAB9APTGS2PAX8
SCHEMBL31037046 0.73 IDO1 (0.47) ABHD16ANPC1RAB9APTGS2PAX8

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3932909-B1 BENZOINDAZOLONE COMPOUND, AND INTERMEDIATE THEREOF LMITO THERAPEUTICS INC (KR) 2025-04-02 — — EP claimed
CN-113454068-B Benzonazolone compounds and intermediates thereof LMITO药业株式会社 2024-08-02 — — CN claimed
CN-113454068-B Benzonazolone compounds and intermediates thereof LMITO药业株式会社 2024-08-02 — — CN disclosed
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