SCHEMBL1808960

SCHEMBL1808960

COCc1cccc(F)c1-n1cc(CO)c(C)n1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 14/20 0.42
KCNN4 O15554 1/20 0.38
CXCR2 P25025 1/20 0.35
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RAB9A P51151 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HTT P42858 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPC1 O15118 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALOX12 P18054 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL27872008 0.83 KCNN4 (0.36) OPRL1KCNN4
SCHEMBL27871974 0.83 P2RX7 (0.39) OPRL1KCNN4KDM4EMEN1KMT2A
SCHEMBL11972707 0.83 OPRL1 (0.39) OPRL1SMN1; SMN2MEN1KMT2A
SCHEMBL1813166 0.82 OPRL1 (0.49) OPRL1RAB9ANPC1MEN1KMT2A
SCHEMBL27871912 0.80 OPRL1 (0.40) OPRL1TSHRMAPK1HSD17B10RAB9A
SCHEMBL1808442 0.80 ALDH1A1 (0.39) KCNN4HTTSMN1; SMN2MEN1KMT2A
SCHEMBL1807100 0.79 L3MBTL1 (0.39) TSHRMAPK1RAB9AKDM4ESMN1; SMN2
SCHEMBL27888227 0.77 OPRL1 (0.42) OPRL1KDM4EHTT
SCHEMBL1813010 0.76 OPRL1 (0.53) OPRL1
SCHEMBL11972686 0.76 OPRL1 (0.40) OPRL1HSD17B10RAB9AKDM4ESMN1; SMN2

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-2501704-B1 Spiropiperidine compounds as oral-1 receptor antagagonisten LILLY CO ELI (US) 2013-09-18 EP disclosed
EP-2501704-A1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS Eli Lilly and Company (US) 2012-09-26 EP disclosed
CN-102666550-A Spiropiperidine compounds as ORL-1 receptor antagonists LILLY CO ELI 2012-09-12 CN disclosed
US-20120214784-A1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2012-08-23 US disclosed
WO-2011060217-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-20120214784-A1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS OPRL1, ORMDL3, OGFRL1 OPRL1 1/4885KCNN4 1201/4885CXCR2 790/4885

“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.