SCHEMBL867419

SCHEMBL867419

O=C(c1ccc(Cc2ccccc2)cc1)N1CC(N2CCN(c3ccccc3)C(=O)C2)C1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.46
MGLL Q99685 4/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL3 Q96JM7 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HSD17B10 Q99714 1/20 0.40
HRH1 P35367 2/20 0.40
KCNH2 Q12809 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MBTD1 Q05BQ5 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL868364 0.87 MEN1 (0.53) HRH3MGLLMEN1KMT2AL3MBTL3
SCHEMBL693648 0.81 KDM4E (0.56) HRH3MGLLMEN1KMT2AL3MBTL3
SCHEMBL867597 0.75 SLC6A7 (0.54) MGLLMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL3771956 0.74 SLC6A7 (0.57) MGLLMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL15949453 0.73 CA1 (0.43) MGLLL3MBTL3L3MBTL1ALDH1A1
SCHEMBL693937 0.73 CA1 (0.47) MGLLL3MBTL3L3MBTL1
SCHEMBL903464 0.73 GPR119 (0.52) KCNH2KDM4E
SCHEMBL15703623 0.72 ALDH1A1 (0.58) HRH3MEN1LMNAKMT2AL3MBTL1
SCHEMBL3917660 0.72 KDM4E (0.68) HRH3L3MBTL3L3MBTL1ALDH1A1MBTD1
SCHEMBL15949414 0.72 MGLL (0.64) HRH3MGLLMEN1KMT2AL3MBTL3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8637498-B2 Oxopiperazine-azetidine amides and oxodiazepine-azetidine amides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2014-01-28 US disclosed
US-20120077797-A1 OXOPIPERAZINE-AZETIDINE AMIDES AND OXODIAZEPINE-AZETIDINE AMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2012-03-29 US 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-20120077797-A1 OXOPIPERAZINE-AZETIDINE AMIDES AND OXODIAZEPINE-AZETIDINE AMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS LPL, PNLIP, LIPA HRH3 2358/4885MGLL 6/4885MEN1 4429/4885

“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.