SCHEMBL1457555

SCHEMBL1457555

O=C(NCc1ccc(Cl)cc1)OC1=NOC2(CCN(C(=S)Nc3ccccc3Cl)CC2)C1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.44
LMNA P02545 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
HTT P42858 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL1457531 0.92 KMT2A (0.37) GAALMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL1457213 0.90 KMT2A (0.43) GAALMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL1457633 0.90 LMNA (0.37) GAALMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL1457432 0.90 MEN1 (0.45) GAALMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL1457551 0.88 ALDH1A1 (0.41) GAALMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL1457423 0.86 ALDH1A1 (0.44) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL5121165 0.85 GAA (0.47) GAALMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL1457145 0.85 NPC1 (0.47) GAALMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL1457500 0.85 POLB (0.47) GAALMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL1457068 0.84 MEN1 (0.40) KMT2AMEN1HTTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2292625-B1 SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF MEDICAMENTS GRUENENTHAL GMBH (DE) 2013-12-25 EP claimed
EP-1893620-A2 SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF DRUGS Grünenthal GmbH (DE) 2008-03-05 EP claimed
WO-2006122769-A2 SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF DRUGS Grünenthal GmbH (DE) 2006-11-23 WO claimed
EP-2292625-B1 SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF MEDICAMENTS GRUENENTHAL GMBH (DE) 2013-12-25 EP disclosed
EP-2292625-A1 Substituted spiro compounds and their use for producing pain-relief medicaments Grünenthal GmbH (DE) 2011-03-09 EP disclosed
EP-1893620-A2 SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF DRUGS Grünenthal GmbH (DE) 2008-03-05 EP disclosed
WO-2006122769-A2 SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF DRUGS Grünenthal GmbH (DE) 2006-11-23 WO disclosed