SCHEMBL8940303

SCHEMBL8940303

CC(O)C(=O)Oc1cccc2nc3ccccc3nc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 6/20 0.54
ALDH1A1 P00352 4/20 0.45
MAPT P10636 7/20 0.42
KMT2A Q03164 6/20 0.42
RAB9A P51151 5/20 0.42
MEN1 O00255 4/20 0.42
POLB P06746 2/20 0.42
THRB P10828 2/20 0.42
BLM P54132 2/20 0.42
CASP6 P55212 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GAA P10253 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NPC1 O15118 3/20 0.42
LMNA P02545 2/20 0.42
G6PD P11413 1/20 0.42
PKM P14618 1/20 0.42
KDM4E B2RXH2 2/20 0.42
ATM Q13315 2/20 0.42
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
SCHEMBL28092677 0.88 NQO2 (0.53) NQO2ALDH1A1MAPTKMT2ARAB9A
SCHEMBL28567770 0.81 NQO2 (0.61) NQO2ALDH1A1MAPTKMT2ARAB9A
SCHEMBL6213177 0.80 NQO2 (0.59) NQO2ALDH1A1MAPTKMT2ARAB9A
SCHEMBL30914171 0.79 BCHE (0.52) NQO2ALDH1A1MAPTKMT2ARAB9A
SCHEMBL317958 0.79 NQO2 (0.58) NQO2ALDH1A1MAPTKMT2ARAB9A
SCHEMBL10926264 0.78 MAPT (0.43) NQO2ALDH1A1MAPTKMT2ARAB9A
SCHEMBL28384802 0.78 NQO2 (0.53) NQO2ALDH1A1MAPTKMT2ARAB9A
SCHEMBL28375189 0.76 NQO2 (0.54) NQO2ALDH1A1MAPTKMT2ARAB9A
SCHEMBL27660507 0.74 ALDH1A1 (0.58) ALDH1A1KMT2ARAB9AMEN1SMN1; SMN2
SCHEMBL30914170 0.74 NQO2 (0.55) NQO2ALDH1A1MAPTKMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111818954-B Breath actuated inhaler 诺尔顿沃特福德有限公司 2021-11-05 CN disclosed
CN-109439561-B Pseudomonas aeruginosa and application thereof 广西师范大学 2020-12-08 CN disclosed
CN-111818954-A Breath actuated inhaler 诺尔顿沃特福德有限公司 2020-10-23 CN disclosed
EP-0710358-A4 POTENTIOMETRIC BIOSENSOR AND THE METHOD OF ITS USE BOEHRINGER MANNHEIM CORP (US) 1996-09-11 EP disclosed
EP-0710358-A1 POTENTIOMETRIC BIOSENSOR AND THE METHOD OF ITS USE BOEHRINGER MANNHEIM CORPORATION (US) 1996-05-08 EP disclosed
WO-1995003543-A1 POTENTIOMETRIC BIOSENSOR AND THE METHOD OF ITS USE BOEHRINGER MANNHEIM CORPORATION (US) 1995-02-02 WO disclosed
US-4391904-A Test strip kits in immunoassays and compositions therein SYVA COMPANY (US) 1983-07-05 US disclosed
US-4366241-A Concentrating zone method in heterogeneous immunoassays SYVA COMPANY (US) 1982-12-28 US disclosed
US-4299916-A COLORIMETRIC ANALYSIS OF ANALYTES SYVA COMPANY (US) 1981-11-10 US disclosed