SCHEMBL7484132

SCHEMBL7484132

Cc1n[c]c2ncn(Cc3ccccc3)c2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 1/20 0.44
ADORA2B P29275 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
ADORA2A P29274 1/20 0.43
PI4KA P42356 1/20 0.43
PI4K2B Q8TCG2 1/20 0.43
PI4K2A Q9BTU6 1/20 0.43
PI4KB Q9UBF8 1/20 0.43
LMNA P02545 1/20 0.42
TNF P01375 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
PNP P00491 2/20 0.41
CDK1 P06493 1/20 0.41
ACP1 P24666 1/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41

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
SCHEMBL7488831 0.83 ADORA2A (0.44) YTHDC1ADORA2BSMN1; SMN2RXFP1ADORA2A
SCHEMBL7489441 0.82 YTHDC1 (0.41) YTHDC1ADORA2BSMN1; SMN2RXFP1ADORA2A
SCHEMBL7492336 0.79 PDE4A (0.39) YTHDC1ADORA2BSMN1; SMN2RXFP1ADORA2A
SCHEMBL7488243 0.78 ADORA2B (0.40) YTHDC1ADORA2BSMN1; SMN2RXFP1ADORA2A
SCHEMBL7492011 0.77 CYP19A1 (0.40) YTHDC1ADORA2BSMN1; SMN2RXFP1
SCHEMBL7489715 0.77 LMNA (0.42) YTHDC1ADORA2BSMN1; SMN2RXFP1ADORA2A
SCHEMBL5731732 0.71 PDE4A (0.66) YTHDC1ADORA2BADORA2API4KAPI4K2B
SCHEMBL7488235 0.70 DYRK1A (0.35) YTHDC1ADORA2BADORA2ACDK1
SCHEMBL7539186 0.69 TSHR (0.47) SMN1; SMN2ADORA2ALMNA
SCHEMBL7488843 0.68 CNOT7 (0.43) ADORA2BADORA2APDE4APDE4BPDE4C

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