SCHEMBL1806339

SCHEMBL1806339

Cc1nn(-c2ncccc2CN(C)C)cc1CO

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 7/20 0.46
KCNH2 Q12809 4/20 0.36
OPRM1 P35372 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
SYK P43405 2/20 0.35
SLC6A4 P31645 5/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
ZAP70 P43403 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SLC6A2 P23975 2/20 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
SCHEMBL1806878 0.82 OPRL1 (0.47) OPRL1KCNH2OPRM1MEN1KMT2A
SCHEMBL28799833 0.81 OPRL1 (0.41) OPRL1SYKSLC6A4KDM4ESLC6A2
SCHEMBL1808569 0.80 SLC6A4 (0.38) KCNH2MEN1KMT2ASYKSLC6A4
SCHEMBL1806018 0.80 OPRL1 (0.41) OPRL1KCNH2OPRM1MEN1KMT2A
SCHEMBL1805932 0.77 NPC1 (0.41) OPRL1NPC1RAB9AKDM4EHTT
SCHEMBL1813166 0.75 OPRL1 (0.49) OPRL1KCNH2MEN1KMT2ASYK
SCHEMBL1808403 0.75 OPRL1 (0.39) OPRL1KCNH2OPRM1MEN1KMT2A
SCHEMBL4034446 0.72 SMN1; SMN2 (0.44) MEN1KMT2ASYKNPC1RAB9A
SCHEMBL1806228 0.70 ELANE (0.44) NPC1RAB9AKDM4EHTT
SCHEMBL21598933 0.69 CYP1A2 (0.42) SLC6A4KDM4ELMNASLC6A2

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
EP-2501703-B1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2013-09-18 EP disclosed
EP-2501703-A1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS Eli Lilly and Company (US) 2012-09-26 EP disclosed
US-8232289-B2 Spiropiperidine compounds as ORL-1 receptor antagonists ELI LILLY AND COMPANY (US) 2012-07-31 US disclosed
CN-102612520-A Spiropiperidine compounds as orl-1 receptor antagonists LILLY CO ELI 2012-07-25 CN disclosed
US-20110118251-A1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2011-05-19 US disclosed
WO-2011060035-A1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2011-05-19 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 (1 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-20110118251-A1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS OXER1, OGFRL1, ORMDL3 OPRL1 4/4885KCNH2 897/4885OPRM1 65/4885

“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.