SCHEMBL6573258

SCHEMBL6573258

CC=C1CN(C(=O)OC(C)(C)C)CCC1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 1/20 0.47
▸ NR1H2 P55055 2/20 0.46
▸ ADORA1 P30542 2/20 0.43
▸ USP2 O75604 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ MAPK1 P28482 1/20 0.40
▸ MAPT P10636 4/20 0.39
▸ ACHE P22303 1/20 0.38
▸ PDK4 Q16654 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ THRB P10828 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ PARP1 P09874 1/20 0.37
▸ TNKS2 Q9H2K2 1/20 0.37
▸ PARP2 Q9UGN5 1/20 0.37
▸ DDB1 Q16531 1/20 0.37
▸ CRBN Q96SW2 1/20 0.37
▸ GRM5 P41594 1/20 0.36
▸ HPGD P15428 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
SCHEMBL6573257 1.00 ESR2 (0.47) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL15459811 0.88 ESR2 (0.47) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL25275525 0.88 ESR2 (0.47) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL15248097 0.86 USP2 (0.41) ESR2NR1H2USP2SMN1; SMN2MAPK1
SCHEMBL15459812 0.85 ESR2 (0.45) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL785941 0.84 ESR2 (0.44) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL803643 0.84 ESR2 (0.44) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL785942 0.84 ESR2 (0.44) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL15898449 0.84 ESR2 (0.44) ESR2NR1H2ADORA1USP2SMN1; SMN2
SCHEMBL28162024 0.84 ESR2 (0.44) ESR2NR1H2ADORA1USP2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100369896-C Cyclic amine compound SANKYO CO (JP) 2008-02-20 — — CN disclosed
CN-1192019-C Cyclic amine derivatives SANKYO CO (JP) 2005-03-09 — — CN disclosed
EP-0934928-B1 CYCLIC AMINE DERIVATIVES SANKYO CO (JP) 2004-10-13 — — EP disclosed
US-6610708-B1 Anticoagulants SANKYO COMPANY, LIMITED (JP) 2003-08-26 — — US disclosed
EP-1063230-B1 CYCLIC AMINO COMPOUNDS SANKYO CO (JP) 2003-04-23 — — EP disclosed
CN-1298389-A Cyclic amine compound SANKYO CO (JP) 2001-06-06 — — CN disclosed
EP-1063230-A1 CYCLIC AMINO COMPOUNDS Sankyo Company Limited (JP) 2000-12-27 — — EP disclosed
US-6087379-A AN ANTICOAGULANT FOR THE TREATMENT AND PREVENTION OF DISEASES AS EMBOLISM, THROMBOSIS OR ARTERIOSCLEROSIS SANKYO COMPANY, LIMITED (JP) 2000-07-11 — — US disclosed
CN-1235596-A Cyclic amine derivatives SANKYO CO (JP) 1999-11-17 — — CN disclosed
EP-0934928-A1 CYCLIC AMINE DERIVATIVES SANKYO COMPANY LIMITED (JP) 1999-08-11 — — EP disclosed
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