SCHEMBL7488243

SCHEMBL7488243

CCCCCc1n[c]c2ncn(Cc3ccccc3)c2n1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
TLR7 Q9NYK1 2/20 0.40
POLB P06746 1/20 0.39
HIF1A Q16665 1/20 0.39
YTHDC1 Q96MU7 1/20 0.39
CYP19A1 P11511 3/20 0.38
HDAC1 Q13547 2/20 0.38
HDAC2 Q92769 2/20 0.38
ADORA2A P29274 1/20 0.37
PI4KA P42356 1/20 0.37
PI4K2B Q8TCG2 1/20 0.37
PI4K2A Q9BTU6 1/20 0.37
PI4KB Q9UBF8 1/20 0.37

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
SCHEMBL7492011 0.99 CYP19A1 (0.40) ADORA2BSMN1; SMN2RXFP1TLR7POLB
SCHEMBL7492336 0.96 PDE4A (0.39) ADORA2BSMN1; SMN2RXFP1POLBHIF1A
SCHEMBL7489441 0.93 YTHDC1 (0.41) ADORA2BSMN1; SMN2RXFP1POLBHIF1A
SCHEMBL7488831 0.86 ADORA2A (0.44) ADORA2BSMN1; SMN2RXFP1YTHDC1ADORA2A
SCHEMBL7491743 0.86 TSHR (0.41) ADORA2BPOLBADORA2A
SCHEMBL7488843 0.86 CNOT7 (0.43) ADORA2BADORA2A
SCHEMBL7486698 0.85 TSHR (0.41) ADORA2BPOLBADORA2A
SCHEMBL7488311 0.85 TSHR (0.41) ADORA2BPOLBADORA2A
SCHEMBL7492592 0.85 TSHR (0.45) ADORA2BTLR7POLBADORA2A
SCHEMBL7494220 0.81 GPR84 (0.39) ADORA2BSMN1; SMN2RXFP1TLR7POLB

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