SCHEMBL7262734

SCHEMBL7262734

O=C1C=CC(=O)C(Nc2ccccn2)=C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ MAPK10 P53779 1/20 0.48
▸ GFER P55789 1/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ NPC1 O15118 4/20 0.42
▸ RAB9A P51151 4/20 0.42
▸ PKM P14618 1/20 0.42
▸ APAF1 O14727 1/20 0.40
▸ TDP2 O95551 1/20 0.40
▸ CDC25B P30305 1/20 0.40
▸ CASP6 P55212 1/20 0.40
▸ RCE1 Q9Y256 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ ADRA2A P08913 2/20 0.39
▸ ADRA2B P18089 2/20 0.39
▸ ADRA2C P18825 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ LMNA P02545 2/20 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
SCHEMBL7268893 0.77 MAPK10 (0.46) KMT2AMEN1MAPK10GFERL3MBTL1
SCHEMBL7264106 0.76 KMT2A (0.44) KMT2AMEN1MAPK10GFERL3MBTL1
SCHEMBL7271120 0.73 RAB9A (0.58) KMT2AMEN1MAPK10GFERL3MBTL1
SCHEMBL7268866 0.73 BACE1 (0.51) KMT2AMEN1MAPK10GFERL3MBTL1
SCHEMBL7264088 0.72 MEN1 (0.44) KMT2AMEN1MAPK10GFERL3MBTL1
SCHEMBL221242 0.72 KMT2A (0.76) KMT2AMEN1MAPK10GFERL3MBTL1
SCHEMBL29391624 0.72 KMT2A (0.76) KMT2AMEN1MAPK10GFERL3MBTL1
SCHEMBL2037194 0.72 MAPT (0.52) KMT2AMEN1L3MBTL1ALDH1A1NPC1
SCHEMBL6574416 0.70 KMT2A (0.73) KMT2AMEN1MAPK10GFERL3MBTL1
SCHEMBL11133606 0.70 KMT2A (0.73) KMT2AMEN1MAPK10GFERL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6653311-B1 Minimal or no effect on cycloxygenase-1 and -2 activity BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY 2003-11-25 — — US claimed
US-6653311-B1 Minimal or no effect on cycloxygenase-1 and -2 activity BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY 2003-11-25 — — US disclosed
US-6653311-B1 Minimal or no effect on cycloxygenase-1 and -2 activity BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY 2003-11-25 — — US disclosed
US-6653311-B1 Minimal or no effect on cycloxygenase-1 and -2 activity BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY 2003-11-25 — — US disclosed
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