SCHEMBL1307757

SCHEMBL1307757

O=C(c1ccc2c(c1)ncn2CCc1nnn[nH]1)N1C2CCC1CC(O)C2

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.40
VNN1 O95497 1/20 0.35
GAA P10253 2/20 0.34
HSD17B10 Q99714 1/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 2/20 0.34
F10 P00742 1/20 0.34
MEN1 O00255 1/20 0.34
NAMPT P43490 2/20 0.34
OXTR P30559 1/20 0.33
KDM1A O60341 1/20 0.33
F2 P00734 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MGLL Q99685 1/20 0.33
PRPS1 P60891 1/20 0.33

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
SCHEMBL12034868 1.00 HPGD (0.40) HPGDVNN1GAAHSD17B10KMT2A
SCHEMBL1308010 0.81 HPGD (0.46) HPGDVNN1GAAHSD17B10KMT2A
SCHEMBL3810404 0.80 HCAR3 (0.44) HPGDGAAHSD17B10KMT2AALDH1A1
SCHEMBL1308659 0.79 HPGD (0.44) HPGDVNN1GAAHSD17B10KMT2A
SCHEMBL1308824 0.79 HSD11B1 (0.43) HPGDGAAHSD17B10KMT2AALDH1A1
SCHEMBL1308941 0.78 HPGD (0.45) HPGDVNN1GAAHSD17B10KMT2A
SCHEMBL3809628 0.78 F10 (0.46) HPGDVNN1GAAHSD17B10KMT2A
SCHEMBL12052701 0.77 NPC1 (0.43) HPGDVNN1GAAKMT2AALDH1A1
SCHEMBL1308827 0.77 HPGD (0.41) HPGDGAAHSD17B10KMT2AALDH1A1
SCHEMBL1306903 0.74 HPGD (0.42) HPGDVNN1GAAHSD17B10KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090118259-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HIGH POINT PHARMACEUTICALS, LLC 2009-05-07 US claimed
US-20110312949-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HIGH POINT PHARMACEUTICALS, LLC (US) 2011-12-22 US disclosed
US-8053431-B2 Pharmaceutical use of substituted amides HIGH POINT PHARMACEUTICALS, LLC (US) 2011-11-08 US disclosed
US-20090118259-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HIGH POINT PHARMACEUTICALS, LLC 2009-05-07 US disclosed
EP-1945207-A2 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES Transtech Pharma, Inc. (US) 2008-07-23 EP disclosed
WO-2007051811-A2 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES TRANSTECH PHARMA (US) 2007-05-10 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 (2 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-20090118259-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HSD11B1, CYP11B1, HSD11B2 HPGD 27/4885VNN1 1690/4885GAA 697/4885
US-20110312949-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HSD11B1, HSD3B1, HSD11B2 HPGD 28/4885VNN1 2004/4885GAA 778/4885

“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.