SCHEMBL8402376

SCHEMBL8402376

O=C1C=c2ccccc2=NC(=O)C1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
SIRT2 Q8IXJ6 1/20 0.33
SIRT1 Q96EB6 1/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
XBP1 P17861 1/20 0.33
MAPK1 P28482 1/20 0.33
ITGA4 P13612 1/20 0.32
ITGB7 P26010 1/20 0.32
KDR P35968 1/20 0.30
TNFRSF1A P19438 1/20 0.30

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
SCHEMBL1235042 0.75 CYP1A2 (0.38) MEN1KMT2AMAPT
SCHEMBL1120018 0.71
SCHEMBL2418026 0.71
Methane SCHEMBL28737048 0.70 MEN1 (0.36) MEN1KMT2ASIRT2SIRT1MAPT
Ammonia Solution, Strong SCHEMBL28139008 0.70 MEN1 (0.36) MEN1KMT2ASIRT2SIRT1MAPT
Charcoal, Activated SCHEMBL29882480 0.70 MEN1 (0.36) MEN1KMT2ASIRT2SIRT1MAPT
SCHEMBL28363865 0.70 MEN1 (0.36) MEN1KMT2ASIRT2SIRT1MAPT
Hydrochloric Acid SCHEMBL6951148 0.70 MEN1 (0.36) MEN1KMT2ASIRT2SIRT1MAPT
SCHEMBL29921145 0.70 MEN1 (0.36) MEN1KMT2ASIRT2SIRT1MAPT
SCHEMBL27590220 0.70 MEN1 (0.36) MEN1KMT2ASIRT2SIRT1MAPT

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-5939412-A Bicyclic fibrinogen antagonists SMITHKLINE BEECHAM CORPORATION (US) 1999-08-17 US disclosed
US-5693636-A Bicyclic fibrinogen antagonists SMITHKLINE BEECHAM CORPORATION (US) 1997-12-02 US disclosed