SCHEMBL8053771

SCHEMBL8053771

NC(=O)Cc1ncc2sccn12

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.36
CHEK1 O14757 1/20 0.36
LIMK1 P53667 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
RECQL P46063 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPK1 P28482 1/20 0.31
PKM P14618 1/20 0.30
TSHR P16473 1/20 0.30
MAPT P10636 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL8041434 0.80 POLB (0.40) DYRK1ACHEK1LIMK1CLK4KDM4E
SCHEMBL8052926 0.78 KDM4E (0.35) DYRK1ACHEK1LIMK1CLK4KDM4E
SCHEMBL7494643 0.78 DYRK1A (0.39) DYRK1ACHEK1LIMK1CLK4KDM4E
Hydrochloric Acid SCHEMBL7890565 0.76 DYRK1A (0.38) DYRK1ACHEK1LIMK1CLK4KDM4E
SCHEMBL7497270 0.75 DYRK1A (0.33) DYRK1ACHEK1LIMK1CLK4KDM4E
SCHEMBL7632455 0.75 DYRK1A (0.39) DYRK1ACHEK1LIMK1CLK4KDM4E
SCHEMBL8053507 0.74 ALOX15 (0.40) DYRK1ACHEK1LIMK1CLK4KDM4E
SCHEMBL8056632 0.73 CHEK1 (0.36) DYRK1ACHEK1LIMK1CLK4KDM4E
SCHEMBL7980854 0.72 KDM4E (0.38) DYRK1ACHEK1LIMK1CLK4KDM4E
SCHEMBL7496405 0.71 CA2 (0.33) KDM4EALDH1A1HPGDHSD17B10PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0669336-B1 NOVEL CEPHEM DERIVATIVES MEIJI SEIKA CO (JP) 2000-05-17 EP disclosed
US-5663162-A BACTERICIDES AND ANTIBIOTICS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-09-02 US disclosed
EP-0669336-A1 NOVEL CEPHEM DERIVATIVE MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-08-30 EP disclosed