SCHEMBL1724844

SCHEMBL1724844

O=C(O)C1Cc2c(O)cccc2CN1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.44
GRIA2 P42262 1/20 0.44
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
CHRM3 P20309 1/20 0.39
DRD2 P14416 2/20 0.38
DRD3 P35462 1/20 0.38

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
SCHEMBL9548214 0.87 GAA (0.46) EGLN1GRIA2GAAMAPTDRD2
SCHEMBL13534830 0.86 CHRM3 (0.41) CHRM3DRD2
SCHEMBL30543100 0.83 EGLN1 (0.43) EGLN1GRIA2GAAMAPT
SCHEMBL16268692 0.83 EGLN1 (0.43) EGLN1GRIA2GAAMAPT
SCHEMBL4478717 0.83 EGLN1 (0.43) EGLN1GRIA2GAAMAPT
SCHEMBL31651974 0.83 EGLN1 (0.43) EGLN1GRIA2GAAMAPT
SCHEMBL3429946 0.82 KDM4E (0.53) GAAMAPTCHRM3DRD2
Hydrochloric Acid SCHEMBL16267702 0.81 EGLN1 (0.42) EGLN1GRIA2GAAMAPT
Hydrochloric Acid SCHEMBL32677117 0.81 EGLN1 (0.42) EGLN1GRIA2GAAMAPT
Hydrochloric Acid SCHEMBL32677096 0.81 EGLN1 (0.42) EGLN1GRIA2GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3274361-A1 BETA-HAIRPIN PEPTIDOMIMETICS Polyphor Ag (CH) 2018-01-31 EP disclosed
WO-2016150576-A1 BETA-HAIRPIN PEPTIDOMIMETICS POLYPHOR AG (CH) 2016-09-29 WO disclosed
EP-2978772-A1 BETA-HAIRPIN PEPTIDOMIMETICS Polyphor AG (CH) 2016-02-03 EP disclosed
EP-2978771-A1 BETA-HAIRPIN PEPTIDOMIMETICS Polyphor Ag (CH) 2016-02-03 EP disclosed
EP-2897949-A1 IAP ANTAGONISTS Bristol-Myers Squibb Company (US) 2015-07-29 EP disclosed
EP-2861581-A1 IAP ANTAGONISTS Bristol-Myers Squibb Company (US) 2015-04-22 EP disclosed
WO-2014161782-A1 BETA-HAIRPIN PEPTIDOMIMETICS POLYPHOR AG (CH) 2014-10-09 WO disclosed
WO-2014161781-A1 BETA-HAIRPIN PEPTIDOMIMETICS POLYPHOR AG (CH) 2014-10-09 WO disclosed
WO-2014047024-A1 IAP ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-03-27 WO disclosed
WO-2013192286-A1 IAP ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2013-12-27 WO disclosed
EP-2406247-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS Prosidion Limited (GB) 2012-01-18 EP disclosed
WO-2010103333-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-09-16 WO disclosed
EP-2200609-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS Prosidion Limited (GB) 2010-06-30 EP disclosed
WO-2009034388-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2009-03-19 WO disclosed