SCHEMBL7992303

SCHEMBL7992303

Oc1cccc(-c2nc(O)c3c(ncn3CCCc3ccccc3)n2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNOT7 Q9UIV1 2/20 0.40
TSHR P16473 1/20 0.40
CASR P41180 1/20 0.40
OPRM1 P35372 8/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
FAAH O00519 1/20 0.39
PIK3CA P42336 1/20 0.37
MTOR P42345 1/20 0.37
PIK3CG P48736 1/20 0.37
COMT P21964 1/20 0.37
OPRD1 P41143 4/20 0.36
OPRK1 P41145 2/20 0.36
ADRA2A P08913 1/20 0.36
AR P10275 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36
HTR2A P28223 1/20 0.36

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
SCHEMBL7984406 0.93 CASR (0.43) CNOT7CASRPIK3CAMTORPIK3CG
SCHEMBL7984242 0.91 CNOT7 (0.45) CNOT7TSHRKDM4ELMNAPOLB
SCHEMBL7986355 0.89 SIGMAR1 (0.42) CNOT7TSHROPRM1KDM4ELMNA
SCHEMBL7974291 0.89 CNOT7 (0.39) CNOT7TSHRKDM4ELMNAPOLB
SCHEMBL7987628 0.89 PDE4B (0.40) CNOT7TSHRKDM4ELMNAPOLB
SCHEMBL7984897 0.87 GAA (0.46) TSHROPRM1LMNAMAPK1FAAH
SCHEMBL7985336 0.86 PIK3CA (0.42) MAPK1PIK3CAMTORPIK3CGADORA3
SCHEMBL7991652 0.84 CNOT7 (0.42) CNOT7TSHRKDM4ELMNAPOLB
SCHEMBL7974043 0.84 GBA1 (0.43) CNOT7TSHRKDM4ELMNAPOLB
SCHEMBL7974615 0.84 ADORA2A (0.44) CNOT7ADORA3ADORA1ADORA2A

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