SCHEMBL7987612

SCHEMBL7987612

CCCCc1nc(=O)c2c(ncn2Cc2ccccc2)[nH]1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNOT7 Q9UIV1 3/20 0.51
PARN O95453 1/20 0.51
PARP1 P09874 1/20 0.44
PNP P00491 2/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 2/20 0.43
BRD4 O60885 1/20 0.42
ADORA2B P29275 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
POLB P06746 1/20 0.41
HIF1A Q16665 1/20 0.41
PDE4A P27815 2/20 0.40
PDE4B Q07343 2/20 0.40
PDE4C Q08493 2/20 0.40
PDE4D Q08499 2/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL7989567 0.97 CNOT7 (0.50) CNOT7PARNPARP1PNPHPGD
SCHEMBL7989411 0.93 CNOT7 (0.53) CNOT7PARNPNPHPGDSMN1; SMN2
SCHEMBL7988844 0.89 CNOT7 (0.49) CNOT7PARNPNPHPGDSMN1; SMN2
SCHEMBL7985323 0.88 CNOT7 (0.51) CNOT7PARNPNPHPGDSMN1; SMN2
SCHEMBL7975254 0.88 CNOT7 (0.55) CNOT7PARNPNPHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL7975100 0.88 CNOT7 (0.48) CNOT7PARNPNPHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL7987750 0.87 CNOT7 (0.50) CNOT7PARNPNPHPGDSMN1; SMN2
SCHEMBL7987705 0.86 CNOT7 (0.51) CNOT7PARNPNPHPGDSMN1; SMN2
SCHEMBL7985640 0.86 CNOT7 (0.53) CNOT7PARNPNPHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL7987861 0.85 CNOT7 (0.50) CNOT7PARNPNPHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6310070-B1 FOR TREATING NEPHRITIS, IMPROVING PROTEINURIA DUE TO GLOMERULONEPHRITIS AND PREVENTING AGGRAVATION OF NEPHRITIS JAPAN ENERGY CORPORATION (JP) 2001-10-30 US disclosed
EP-0999211-A1 NOVEL PURINE DERIVATIVES AND MEDICINAL USE THEREOF JAPAN ENERGY CORPORATION (JP) 2000-05-10 EP disclosed