SCHEMBL8623095

SCHEMBL8623095

CC(C)(C)OC(=O)N1CCC(c2nc(C(=O)O)c[nH]2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
THRB P10828 2/20 0.50
MAPT P10636 1/20 0.50
HPGDS O60760 2/20 0.49
DDB1 Q16531 1/20 0.46
CRBN Q96SW2 1/20 0.46
NAMPT P43490 1/20 0.46
GPR119 Q8TDV5 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 2/20 0.45
USP2 O75604 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
JAK2 O60674 1/20 0.44
JAK1 P23458 1/20 0.44
TYK2 P29597 1/20 0.44
JAK3 P52333 1/20 0.44
IGF1R P08069 1/20 0.44
HTT P42858 2/20 0.43

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
SCHEMBL8624453 0.88 KDM4E (0.48) KDM4ETHRBMAPTHPGDSDDB1
SCHEMBL2512441 0.85 KDM4E (0.52) KDM4ETHRBMAPTHPGDSDDB1
SCHEMBL8550947 0.84 KDM4E (0.51) KDM4ETHRBMAPTHPGDSDDB1
SCHEMBL16457597 0.84 KDM4E (0.51) KDM4ETHRBMAPTHPGDSDDB1
SCHEMBL1665015 0.84 KDM4E (0.51) KDM4ETHRBMAPTHPGDSDDB1
SCHEMBL14782658 0.84 KDM4E (0.51) KDM4ETHRBMAPTHPGDSDDB1
SCHEMBL8625121 0.83 KDM4E (0.46) KDM4ETHRBMAPTHPGDSDDB1
SCHEMBL1662413 0.82 KDM4E (0.49) KDM4ETHRBMAPTHPGDSDDB1
SCHEMBL16457438 0.82 KDM4E (0.50) KDM4ETHRBMAPTHPGDSDDB1
SCHEMBL16457400 0.82 KDM4E (0.49) KDM4ETHRBMAPTHPGDSDDB1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5817677-A ANTITHROMBOSIS AGENTS DR. KARL THOMAE GMBH (DE) 1998-10-06 US disclosed