SCHEMBL1491508

SCHEMBL1491508

NCC1CCC(CN[C@H](C(=O)OC2CCCC2)c2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MMP2 P08253 2/20 0.47
MMP9 P14780 2/20 0.47
ANPEP P15144 2/20 0.47
LTA4H P09960 1/20 0.47
LAP3 P28838 1/20 0.47
NPEPPS P55786 1/20 0.47
ERAP2 Q6P179 1/20 0.47
ERAP1 Q9NZ08 1/20 0.47
F10 P00742 4/20 0.44
PRSS1 P07477 2/20 0.44
F2 P00734 1/20 0.44
TPSAB1 Q15661 1/20 0.43
TPSD1 Q9BZJ3 1/20 0.43
TPSG1 Q9NRR2 1/20 0.43
MAPK14 Q16539 2/20 0.42
CYP2D6 P10635 4/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL1491510 1.00 MEN1 (0.48) MEN1KMT2ANPSR1MMP2MMP9
SCHEMBL12810084 0.86 MEN1 (0.48) MEN1KMT2ANPSR1MMP2MMP9
SCHEMBL4418423 0.84 MEN1 (0.47) MEN1KMT2ANPSR1MMP2MMP9
SCHEMBL1491413 0.82 ACACB (0.46) MEN1KMT2ANPSR1MMP2MMP9
SCHEMBL1491416 0.82 ACACB (0.46) MEN1KMT2ANPSR1MMP2MMP9
SCHEMBL8203230 0.79 MEN1 (0.50) MEN1KMT2AMMP2MMP9ANPEP
SCHEMBL27784577 0.79 MEN1 (0.50) MEN1KMT2AMMP2MMP9ANPEP
SCHEMBL1410870 0.79 KDM4E (0.57) MEN1KMT2ANPSR1MMP2MMP9
SCHEMBL5097508 0.75 MEN1 (0.47) MEN1KMT2ANPSR1F10PRSS1
SCHEMBL28386158 0.74 MEN1 (0.49) MEN1KMT2ANPSR1F10PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9133104-B2 Enzyme inhibitors CHROMA THERAPEUTICS LTD. (GB) 2015-09-15 US disclosed
US-20140163042-A1 ENZYME INHIBITORS CHROMA THERAPEUTICS LTD. (GB) 2014-06-12 US disclosed
US-20140163042-A1 ENZYME INHIBITORS CHROMA THERAPEUTICS LTD. (GB) 2014-06-12 US disclosed
US-20140163042-A1 ENZYME INHIBITORS CHROMA THERAPEUTICS LTD. (GB) 2014-06-12 US disclosed
US-20130116318-A1 Enzyme Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2013-05-09 US disclosed
US-20130116318-A1 Enzyme Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2013-05-09 US disclosed
US-20130116318-A1 Enzyme Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2013-05-09 US disclosed
US-7939666-B2 Enzyme inhibitors CHROMA THERAPEUTICS LTD. (GB) 2011-05-10 US disclosed
US-7939666-B2 Enzyme inhibitors CHROMA THERAPEUTICS LTD. (GB) 2011-05-10 US disclosed
US-7939666-B2 Enzyme inhibitors CHROMA THERAPEUTICS LTD. (GB) 2011-05-10 US disclosed
EP-2301939-A1 Enzyme inhibitors Chroma Therapeutics Limited (GB) 2011-03-30 EP disclosed
EP-2301939-A1 Enzyme inhibitors Chroma Therapeutics Limited (GB) 2011-03-30 EP disclosed
US-20090291978-A1 Enzyme Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2009-11-26 US disclosed
US-20090291978-A1 Enzyme Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2009-11-26 US disclosed
US-20090291978-A1 Enzyme Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2009-11-26 US disclosed
EP-1879895-A1 ENZYME INHIBITORS Chroma Therapeutics Limited (GB) 2008-01-23 EP disclosed
WO-2006117549-A1 ENZYME INHIBITORS CHROMA THERAPEUTICS LTD (GB) 2006-11-09 WO disclosed
WO-2006117549-A1 ENZYME INHIBITORS CHROMA THERAPEUTICS LTD (GB) 2006-11-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130116318-A1 Enzyme Inhibitors HDAC1, HDAC11, HDAC7 MEN1 2620/4885KMT2A 101/4885NPSR1 4425/4885
US-20140163042-A1 ENZYME INHIBITORS HAT1, NR2E1, HDAC3 MEN1 2784/4885KMT2A 177/4885NPSR1 1155/4885
US-20090291978-A1 Enzyme Inhibitors HAT1, NR2E1, NR2C2 MEN1 3381/4885KMT2A 428/4885NPSR1 2152/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.