SCHEMBL7986330

SCHEMBL7986330

O=c1nc(-c2cccnc2)[nH]c2ncn(CCc3ccccc3)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNOT7 Q9UIV1 6/20 0.51
HPGD P15428 1/20 0.43
ALDH1A1 P00352 3/20 0.41
ADRA2C P18825 1/20 0.40
CYP2E1 P05181 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2A6 P11509 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2B6 P20813 1/20 0.40
CYP2C19 P33261 1/20 0.40
DHPS P49366 1/20 0.39
TSHR P16473 1/20 0.39
CLK1 P49759 1/20 0.39
DYRK1A Q13627 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
NPY5R Q15761 1/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL7974048 0.94 CNOT7 (0.53) CNOT7HPGDALDH1A1ADRA2CCYP2E1
SCHEMBL7974620 0.90 CNOT7 (0.58) CNOT7ALDH1A1TSHR
SCHEMBL7974289 0.89 CNOT7 (0.53) CNOT7HPGDALDH1A1CYP2E1CYP3A4
SCHEMBL7991681 0.88 CNOT7 (0.54) CNOT7HPGDALDH1A1MAPT
SCHEMBL7984244 0.83 CNOT7 (0.60) CNOT7ALDH1A1TSHRMAPTRAB9A
SCHEMBL7986324 0.83 HPGD (0.48) CNOT7HPGDALDH1A1CYP2E1CYP3A4
SCHEMBL7973875 0.83 CNOT7 (0.53) CNOT7ALDH1A1TSHR
SCHEMBL7988553 0.82 CNOT7 (0.50) CNOT7ALDH1A1
SCHEMBL7984686 0.82 CNOT7 (0.50) CNOT7ALDH1A1
SCHEMBL7984409 0.82 CNOT7 (0.53) CNOT7ALDH1A1

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