SCHEMBL1436003

SCHEMBL1436003

Oc1ccccc1C=Nc1ccccn1.[Cu]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 4/20 0.55
▸ CA2 P00918 4/20 0.55
▸ CA9 Q16790 3/20 0.55
▸ SIRT2 Q8IXJ6 1/20 0.55
▸ KDM4E B2RXH2 6/20 0.49
▸ MAPT P10636 5/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ GAA P10253 3/20 0.49
▸ RAB9A P51151 3/20 0.49
▸ POLB P06746 2/20 0.49
▸ PKM P14618 1/20 0.49
▸ MCL1 Q07820 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ NLRP3 Q96P20 1/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ RECQL P46063 1/20 0.48
▸ NPC1 O15118 3/20 0.47
▸ ALDH1A1 P00352 3/20 0.46
▸ HTT P42858 3/20 0.45

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
SCHEMBL23495453 1.00 CA12 (0.55) CA12CA2CA9SIRT2KDM4E
SCHEMBL30528140 0.98 CA12 (0.56) CA12CA2CA9SIRT2KDM4E
SCHEMBL30528139 0.98 CA12 (0.56) CA12CA2CA9SIRT2KDM4E
SCHEMBL11331441 0.98 CA12 (0.56) CA12CA2CA9SIRT2KDM4E
SCHEMBL14337425 0.98 CA12 (0.56) CA12CA2CA9SIRT2KDM4E
Hydrochloric Acid SCHEMBL28173474 0.97 CA12 (0.55) CA12CA2CA9SIRT2KDM4E
Hydrochloric Acid SCHEMBL17836076 0.95 CA12 (0.53) CA12CA2CA9SIRT2KDM4E
SCHEMBL28173473 0.93 CA12 (0.51) CA12CA2CA9SIRT2KDM4E
SCHEMBL6679817 0.80 CA12 (0.60) CA12CA2CA9SIRT2KDM4E
SCHEMBL7203706 0.80 CA12 (0.60) CA12CA2CA9SIRT2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11986597-B2 Nitric oxide generating systems for inhalation NOTA Laboratories, LLC (US) 2024-05-21 — — US disclosed
US-20210178106-A1 NITRIC OXIDE GENERATING SYSTEMS FOR INHALATION NOTA Laboratories, LLC 2021-06-17 — — US disclosed
US-8278243-B2 Laser imaging DATALASE LTD. (GB) 2012-10-02 — — US disclosed
EP-1704057-B1 LASER IMAGING DATALASE LTD (GB) 2011-03-30 — — EP disclosed
US-20100075848-A1 Laser Imaging DATALASE LTD. (GB) 2010-03-25 — — US disclosed
EP-1704057-A1 LASER IMAGING Sherwood Technology LTD. (GB) 2006-09-27 — — EP disclosed
WO-2005068207-A1 LASER IMAGING DATALASE LTD. (GB) 2005-07-28 — — WO disclosed
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