SCHEMBL7268893

SCHEMBL7268893

CC1=CC(=O)C(Nc2ccccn2)=CC1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK10 P53779 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ GFER P55789 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ KDR P35968 1/20 0.43
▸ TSHR P16473 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ NPC1 O15118 3/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ PKM P14618 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ TDP2 O95551 2/20 0.38
▸ APAF1 O14727 1/20 0.38
▸ CDC25B P30305 1/20 0.38
▸ CASP6 P55212 1/20 0.38
▸ RCE1 Q9Y256 1/20 0.38
▸ CYP2C19 P33261 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
SCHEMBL7262715 0.80 KDR (0.37) MEN1KMT2AALDH1A1L3MBTL1KDR
SCHEMBL7264088 0.79 MEN1 (0.44) MAPK10MEN1GFERKMT2AALDH1A1
SCHEMBL7271141 0.77 RAB9A (0.37) MEN1KMT2AALDH1A1KDRNPC1
SCHEMBL7262734 0.77 KMT2A (0.48) MAPK10MEN1GFERKMT2AALDH1A1
SCHEMBL7264106 0.76 KMT2A (0.44) MAPK10MEN1GFERKMT2AALDH1A1
SCHEMBL7271120 0.74 RAB9A (0.58) MAPK10MEN1GFERKMT2AALDH1A1
SCHEMBL17817052 0.74 MAPT (0.53) MEN1KMT2AALDH1A1L3MBTL1TSHR
SCHEMBL221242 0.70 KMT2A (0.76) MAPK10MEN1GFERKMT2AALDH1A1
SCHEMBL29391624 0.70 KMT2A (0.76) MAPK10MEN1GFERKMT2AALDH1A1
SCHEMBL12373361 0.68 ALDH1A1 (0.62) MEN1KMT2AALDH1A1KDRLMNA

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
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
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