SCHEMBL8290119

SCHEMBL8290119

Cc1ccc2nc(NC(=O)Nc3cccc(F)c3)sc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 5/20 0.62
DYRK1B Q9Y463 2/20 0.62
HPGDS O60760 1/20 0.59
KDR P35968 1/20 0.59
NPC1 O15118 9/20 0.58
RAB9A P51151 9/20 0.58
MEN1 O00255 5/20 0.58
KMT2A Q03164 5/20 0.58
RIPK1 Q13546 1/20 0.56
RIPK3 Q9Y572 1/20 0.56
MAPT P10636 4/20 0.56
NFKB1 P19838 4/20 0.56
NFKB2 Q00653 4/20 0.56
RELA Q04206 4/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
LMNA P02545 2/20 0.56
POLB P06746 2/20 0.56
LCK P06239 2/20 0.56
HDAC6 Q9UBN7 1/20 0.56
KDM4E B2RXH2 2/20 0.55

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
SCHEMBL27093077 0.90 DYRK1A (0.67) DYRK1ADYRK1BKDRNPC1RAB9A
SCHEMBL4917177 0.87 HPGDS (0.59) DYRK1ADYRK1BHPGDSNPC1RAB9A
SCHEMBL4124786 0.87 DYRK1A (0.74) DYRK1ADYRK1BKDRNPC1RAB9A
SCHEMBL27093078 0.86 KDR (0.75) DYRK1ADYRK1BKDRNPC1RAB9A
SCHEMBL4909989 0.85 RAB9A (0.78) DYRK1ADYRK1BHPGDSNPC1RAB9A
SCHEMBL21568324 0.83 DYRK1A (0.58) DYRK1ADYRK1BKDRNPC1RAB9A
SCHEMBL13329187 0.82 HPGDS (0.69) DYRK1AHPGDSNPC1RAB9AMEN1
SCHEMBL12199338 0.82 HPGDS (0.69) DYRK1AHPGDSNPC1RAB9AMEN1
SCHEMBL17001367 0.82 DYRK1A (0.74) DYRK1ADYRK1BNPC1RAB9AMEN1
SCHEMBL26034943 0.81 DYRK1A (0.54) DYRK1ADYRK1BNPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005037845-A1 BENZOTHIAZOLE AND THIAZOLE[5,5-B] PYRIDINE COMPOSITIONS AND THEIR USE AS UBIQUITIN LIGASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2005-04-28 WO disclosed