SCHEMBL7488235

SCHEMBL7488235

Cc1n[c]c2ncn(C)c2n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.35
CDK1 P06493 1/20 0.33
ADORA2A P29274 2/20 0.32
ADORA1 P30542 2/20 0.32
YTHDC1 Q96MU7 2/20 0.31
PDE2A O00408 1/20 0.31
PIK3CD O00329 1/20 0.31
POLB P06746 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
CNR1 P21554 1/20 0.31
ACHE P22303 1/20 0.31
ADORA2B P29275 1/20 0.31
NTSR1 P30989 1/20 0.31
MC3R P41968 1/20 0.31
NOTUM Q6P988 1/20 0.31
SIRT3 Q9NTG7 1/20 0.31
GDA Q9Y2T3 1/20 0.31
NR2E1 Q9Y466 1/20 0.31
PIK3CG P48736 1/20 0.30
PIK3C3 Q8NEB9 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
SCHEMBL7495203 0.77 CDK1 (0.33) DYRK1ACDK1ADORA2AADORA1
SCHEMBL7489579 0.75 ADORA2A (0.32) DYRK1AADORA2AADORA1ADORA2B
SCHEMBL7487478 0.72 ADORA2A (0.34) DYRK1AADORA2AADORA1ADORA3ADORA2B
SCHEMBL7492084 0.71 ADORA2A (0.35) ADORA2AADORA1ADORA3ADORA2B
SCHEMBL7488641 0.70 ADORA2A (0.34) ADORA2AADORA1ADORA3CNR1ADORA2B
SCHEMBL7484132 0.70 YTHDC1 (0.44) CDK1ADORA2AYTHDC1ADORA2B
SCHEMBL11916299 0.68 CDK1 (0.34) DYRK1ACDK1ADORA2AADORA1YTHDC1
SCHEMBL790146 0.64 CDK1 (0.46) CDK1ADORA2AADORA1YTHDC1PDE2A
SCHEMBL17813482 0.64 GRM5 (0.41) DYRK1ACDK1ADORA2AADORA1YTHDC1
SCHEMBL4402870 0.61 CDK1 (0.66) CDK1ADORA2AADORA1YTHDC1ADORA2B

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-0915093-B1 AMIDE DERIVATIVES OTSUKA PHARMA CO LTD (JP) 2002-11-27 EP disclosed
US-6166016-A Amide derivatives OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2000-12-26 US disclosed
EP-0915093-A1 AMIDE DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1999-05-12 EP disclosed