SCHEMBL8056964

SCHEMBL8056964

CC(C)(C)c1cc(-c2nc(=O)c3c(ncn3Cc3ccccc3)[nH]2)cc(C(C)(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNOT7 Q9UIV1 3/20 0.47
PARN O95453 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.41
ADORA2B P29275 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
HPGD P15428 1/20 0.40
PNP P00491 2/20 0.40
P2RX7 Q99572 2/20 0.40
ALDH1A1 P00352 2/20 0.40
ABCC8 Q09428 1/20 0.39
KCNJ11 Q14654 1/20 0.39
NR1I2 O75469 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
POLB P06746 1/20 0.38
HIF1A Q16665 1/20 0.38
KMT2A Q03164 1/20 0.37
BRD4 O60885 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
SCHEMBL7974492 0.88 ABCC8 (0.47) CNOT7PARNSMN1; SMN2ADORA2BRXFP1
SCHEMBL7985328 0.87 CNOT7 (0.51) CNOT7PARNSMN1; SMN2ADORA2BRXFP1
SCHEMBL7986239 0.87 CNOT7 (0.47) CNOT7PARNSMN1; SMN2ADORA2BRXFP1
SCHEMBL7975271 0.85 CNOT7 (0.56) CNOT7PARNSMN1; SMN2ADORA2BRXFP1
SCHEMBL7988790 0.84 CNOT7 (0.53) CNOT7PARNSMN1; SMN2ADORA2BRXFP1
SCHEMBL7984975 0.83 CXCR2 (0.53) CNOT7PARNSMN1; SMN2HPGDALDH1A1
SCHEMBL8056958 0.83 SMN1; SMN2 (0.52) CNOT7PARNSMN1; SMN2ADORA2BRXFP1
SCHEMBL7984891 0.83 CNOT7 (0.50) CNOT7PARNSMN1; SMN2ADORA2BRXFP1
SCHEMBL7985350 0.83 GAA (0.48) CNOT7PARNRXFP1HPGDP2RX7
SCHEMBL7988685 0.83 PARN (0.41) CNOT7PARNSMN1; SMN2HPGDPNP

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
EP-0999211-A1 NOVEL PURINE DERIVATIVES AND MEDICINAL USE THEREOF JAPAN ENERGY CORPORATION (JP) 2000-05-10 EP disclosed