SCHEMBL1806352

SCHEMBL1806352

CC(=O)NCc1cccnc1-n1cc(C=O)c(C)n1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SETDB1 Q15047 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
MTNR1A P48039 4/20 0.37
CYP2C9 P11712 1/20 0.34
NAMPT P43490 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
LIPG Q9Y5X9 1/20 0.33
AKT1 P31749 1/20 0.33
P2RX7 Q99572 3/20 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
SCHEMBL1807042 0.79 OPRL1 (0.41) L3MBTL1NPSR1
SCHEMBL1806018 0.79 OPRL1 (0.41) L3MBTL1NPSR1
SCHEMBL1804399 0.75 KDM4E (0.40) L3MBTL1
SCHEMBL12625077 0.75 MYC (0.37) L3MBTL1NPSR1P2RX7
SCHEMBL1806557 0.74 FAAH (0.38) L3MBTL1
SCHEMBL1805076 0.74 HDAC9 (0.40) L3MBTL1NPSR1
SCHEMBL1803648 0.74 KCNH2 (0.41) L3MBTL1NPSR1
SCHEMBL30421108 0.73 CYP2C9 (0.54) SETDB1L3MBTL1MTNR1ACYP2C9NAMPT
SCHEMBL19323056 0.73 CYP2C9 (0.54) SETDB1L3MBTL1MTNR1ACYP2C9NAMPT
SCHEMBL1806040 0.71 HSD11B1 (0.40)

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 9 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-B1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2013-09-18 EP disclosed
US-8232289-B2 Spiropiperidine compounds as ORL-1 receptor antagonists ELI LILLY AND COMPANY (US) 2012-07-31 US disclosed
US-8232289-B2 Spiropiperidine compounds as ORL-1 receptor antagonists ELI LILLY AND COMPANY (US) 2012-07-31 US disclosed
US-8232289-B2 Spiropiperidine compounds as ORL-1 receptor antagonists ELI LILLY AND COMPANY (US) 2012-07-31 US disclosed
US-20110118251-A1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2011-05-19 US disclosed
US-20110118251-A1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2011-05-19 US 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 SETDB1 3360/4885L3MBTL1 4213/4885MTNR1A 429/4885

“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.