SCHEMBL7988039

SCHEMBL7988039

CNCc1nc(=O)c2c(ncn2Cc2ccc(C)cc2)[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNOT7 Q9UIV1 3/20 0.41
PARN O95453 1/20 0.41
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
HTT P42858 1/20 0.39
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
BRD4 O60885 1/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CTSL P07711 1/20 0.36
TYMP P19971 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
HPGD P15428 2/20 0.35
MAPK1 P28482 1/20 0.34

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
Hydrochloric Acid SCHEMBL7988145 0.99 CNOT7 (0.40) CNOT7PARNLMNASMN1; SMN2CYP11B1
SCHEMBL7985516 0.89 CNOT7 (0.40) CNOT7PARNLMNASMN1; SMN2CYP11B2
SCHEMBL7984366 0.89 CNOT7 (0.53) CNOT7PARNSMN1; SMN2BRD4KMT2A
Hydrochloric Acid SCHEMBL7988733 0.88 CNOT7 (0.40) CNOT7PARNLMNASMN1; SMN2CYP11B2
Hydrochloric Acid SCHEMBL7992068 0.88 CNOT7 (0.52) CNOT7PARNSMN1; SMN2BRD4KMT2A
SCHEMBL7987439 0.88 CNOT7 (0.43) CNOT7PARNLMNASMN1; SMN2CYP11B1
SCHEMBL7991686 0.87 ABCC8 (0.48) CNOT7PARNLMNASMN1; SMN2CYP11B1
Hydrochloric Acid SCHEMBL7985467 0.86 ABCC8 (0.47) CNOT7PARNLMNASMN1; SMN2CYP11B1
SCHEMBL7988359 0.86 ALDH1A1 (0.44) CNOT7PARNLMNASMN1; SMN2CYP11B1
SCHEMBL7989379 0.86 CNOT7 (0.41) CNOT7PARNLMNASMN1; SMN2CYP11B1

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