SCHEMBL7974261

SCHEMBL7974261

CCc1nc2ncn(CCCc3ccccc3)c2c(=O)[nH]1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.60
KDM4E B2RXH2 1/20 0.60
POLB P06746 1/20 0.60
MAPK1 P28482 1/20 0.60
TSHR P16473 1/20 0.50
CNOT7 Q9UIV1 1/20 0.50
HCAR2 Q8TDS4 4/20 0.46
HPGD P15428 1/20 0.45
ALDH1A1 P00352 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
KMT2A Q03164 2/20 0.44
RECQL P46063 1/20 0.44
MDM2 Q00987 1/20 0.44
MEN1 O00255 1/20 0.43
BRD4 O60885 1/20 0.42

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
SCHEMBL7974531 0.93 KDM4E (0.50) LMNAKDM4EPOLBMAPK1CNOT7
SCHEMBL7987233 0.92 LMNA (0.58) LMNAKDM4EPOLBMAPK1TSHR
SCHEMBL7984942 0.88 KDM4E (0.56) LMNAKDM4EPOLBMAPK1TSHR
SCHEMBL7988855 0.87 LMNA (0.56) LMNAKDM4EPOLBMAPK1TSHR
Hydrochloric Acid SCHEMBL7988003 0.87 KDM4E (0.55) LMNAKDM4EPOLBMAPK1TSHR
SCHEMBL7975251 0.85 SMN1; SMN2 (0.60) CNOT7HPGDALDH1A1SMN1; SMN2KMT2A
SCHEMBL7985534 0.85 L3MBTL1 (0.44) LMNAKDM4EPOLBMAPK1TSHR
SCHEMBL7985079 0.85 KDM4E (0.49) LMNAKDM4EPOLBMAPK1CNOT7
SCHEMBL7984240 0.82 LMNA (0.58) LMNAKDM4EPOLBMAPK1TSHR
SCHEMBL7985770 0.81 CNOT7 (0.50) LMNAPOLBMAPK1TSHRCNOT7

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