SCHEMBL2967595

SCHEMBL2967595

Cc1cc(=O)oc2cc(NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](C)NC(=O)[C@H](C)N3C(=O)CCC3=O)ccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.52
TDP1 Q9NUW8 2/20 0.51
KDM4E B2RXH2 7/20 0.49
ALDH1A1 P00352 7/20 0.49
HPGD P15428 6/20 0.49
IGLV6-57 P01721 1/20 0.46
HSD17B10 Q99714 3/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
GAA P10253 2/20 0.44
GLA P06280 1/20 0.44
CA12 O43570 3/20 0.44
CA9 Q16790 3/20 0.44
CA1 P00915 1/20 0.44
NPC1 O15118 3/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL3366173 0.87 RAB9A (0.56) RAB9ATDP1KDM4EALDH1A1HPGD
SCHEMBL30839619 0.87 RAB9A (0.56) RAB9ATDP1KDM4EALDH1A1HPGD
SCHEMBL29543574 0.87 RAB9A (0.56) RAB9ATDP1KDM4EALDH1A1HPGD
SCHEMBL3321719 0.86 KDM4E (0.44) RAB9ATDP1KDM4EALDH1A1HPGD
SCHEMBL14050123 0.85 KDM4E (0.63) RAB9ATDP1KDM4EALDH1A1HPGD
SCHEMBL5672583 0.85 KDM4E (0.44) RAB9ATDP1KDM4EALDH1A1HPGD
SCHEMBL19305830 0.80 TDP1 (0.49) RAB9ATDP1KDM4EALDH1A1HPGD
SCHEMBL29543904 0.80 RAB9A (0.64) RAB9ATDP1KDM4EALDH1A1HPGD
SCHEMBL1767417 0.80 TDP1 (0.44) RAB9ATDP1KDM4EALDH1A1HPGD
SCHEMBL29543943 0.80 KDM4E (0.70) RAB9ATDP1KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2230312-A1 Probe compound for detecting and isolating enzymes and means and methods using the same Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2010-09-22 EP disclosed
US-20060142171-A1 Novel alkaline protease FORSKARPATENT I SYD AB (SE) 2006-06-29 US disclosed
EP-1611235-A1 NOVEL ALKALINE PROTEASE Forskarpatent i Syd AB (SE) 2006-01-04 EP disclosed
WO-2004085639-A9 NOVEL ALKALINE PROTEASE FORSKARPATENT I SYD AB (SE) 2005-11-10 WO disclosed
WO-2004085639-A1 NOVEL ALKALINE PROTEASE FORSKARPATENT I SYD AB (SE) 2004-10-07 WO disclosed