SCHEMBL7974041

SCHEMBL7974041

O=c1[nH]c(-c2cccnc2)nc2ncn(CCCc3ccccc3)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.51
LMNA P02545 1/20 0.51
POLB P06746 1/20 0.51
MAPK1 P28482 1/20 0.51
HPGD P15428 2/20 0.46
CNOT7 Q9UIV1 1/20 0.45
TSHR P16473 2/20 0.43
PNP P00491 1/20 0.42
MAPT P10636 2/20 0.41
KDM4C Q9H3R0 1/20 0.41
ALDH1A1 P00352 5/20 0.41
GAA P10253 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
PRMT5 O14744 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KMT2A Q03164 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
CYP2E1 P05181 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38

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
SCHEMBL7986324 0.94 HPGD (0.48) KDM4ELMNAPOLBMAPK1HPGD
SCHEMBL7984240 0.90 LMNA (0.58) KDM4ELMNAPOLBMAPK1HPGD
SCHEMBL7991648 0.89 KDM4E (0.54) KDM4ELMNAPOLBMAPK1HPGD
SCHEMBL7974283 0.87 ALDH1A1 (0.53) KDM4EHPGDCNOT7PNPMAPT
SCHEMBL7974048 0.84 CNOT7 (0.53) KDM4ELMNAPOLBMAPK1HPGD
SCHEMBL7974613 0.84 CNOT7 (0.49) KDM4ELMNAPOLBMAPK1HPGD
SCHEMBL7985608 0.83 LMNA (0.53) KDM4ELMNAPOLBMAPK1HPGD
SCHEMBL7984488 0.83 LMNA (0.53) KDM4ELMNAPOLBMAPK1HPGD
SCHEMBL7974290 0.83 KDM4E (0.50) KDM4ELMNAPOLBMAPK1HPGD
SCHEMBL7992300 0.83 LMNA (0.50) KDM4ELMNAPOLBMAPK1HPGD

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