SCHEMBL7987627

SCHEMBL7987627

O=c1[nH]c(-c2cccc(Cl)c2)nc2ncn(CCCc3ccccc3)c12

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.50
MAPK1 P28482 1/20 0.50
CNOT7 Q9UIV1 1/20 0.44
PIN1 Q13526 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 3/20 0.43
TSHR P16473 2/20 0.42
TP53 P04637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HPGD P15428 1/20 0.41
CXCR2 P25025 1/20 0.40
ACP1 P24666 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
SCHEMBL7988550 0.94 ALDH1A1 (0.44) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7984240 0.90 LMNA (0.58) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7974010 0.89 SMN1; SMN2 (0.53) CNOT7PIN1SMN1; SMN2KMT2AALDH1A1
SCHEMBL7974290 0.88 KDM4E (0.50) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7986351 0.88 KDM4E (0.50) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7992300 0.88 LMNA (0.50) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7984893 0.85 KDM4E (0.50) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7973624 0.84 SMN1; SMN2 (0.48) MAPK1SMN1; SMN2KMT2AALDH1A1HPGD
SCHEMBL7987629 0.84 CNOT7 (0.52) KDM4ELMNAPOLBMAPK1CNOT7
SCHEMBL7988662 0.83 SMN1; SMN2 (0.53) MAPK1CNOT7SMN1; SMN2KMT2AALDH1A1

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