SCHEMBL14570568

SCHEMBL14570568

CCOC(=O)/C=C1/C[C@H]2CC[C@H]2C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.50
HCAR2 Q8TDS4 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
HPGD P15428 3/20 0.37
MAPK1 P28482 2/20 0.37
HSD17B10 Q99714 2/20 0.37
RECQL P46063 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
LMNA P02545 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
EPHX2 P34913 1/20 0.35
CA12 O43570 1/20 0.34

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
SCHEMBL8345066 1.00 ESR2 (0.50) ESR2HCAR2NPSR1HPGDMAPK1
SCHEMBL8344811 1.00 ESR2 (0.50) ESR2HCAR2NPSR1HPGDMAPK1
SCHEMBL14570632 1.00 ESR2 (0.50) ESR2HCAR2NPSR1HPGDMAPK1
SCHEMBL8348944 0.93 ESR2 (0.48) ESR2HCAR2NPSR1HPGDMAPK1
SCHEMBL14559596 0.93 ESR2 (0.48) ESR2HCAR2NPSR1HPGDMAPK1
SCHEMBL8348401 0.93 ESR2 (0.48) ESR2HCAR2NPSR1HPGDMAPK1
SCHEMBL8349576 0.93 ESR2 (0.48) ESR2HCAR2NPSR1HPGDMAPK1
SCHEMBL10790263 0.84 ESR2 (0.47) ESR2HCAR2NPSR1HPGDMAPK1
SCHEMBL11018845 0.84 ESR2 (0.47) ESR2HCAR2NPSR1HPGDMAPK1
SCHEMBL5084409 0.83 ESR2 (0.48) ESR2HCAR2NPSR1HPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506955-B1 Bicyclic amino acids as pharmaceuticals agents WARNER LAMBERT CO (US) 2007-03-28 EP disclosed
US-7189747-B2 Method of treating noninflammatory cartilage damage WARNER-LAMBERT COMPANY (US) 2007-03-13 US disclosed
WO-2003063845-A1 ALPHA 2 DELTA LIGANDS TO TREAT TINNITUS WARNER-LAMBERT COMPANY LLC (US) 2003-08-07 WO disclosed