SCHEMBL951185

SCHEMBL951185

CC(C)(C)C(=O)CN1CCc2c[c]ccc2C1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
ALDH1A1 P00352 4/20 0.39
POLB P06746 2/20 0.39
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.37
GFER P55789 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
DRD2 P14416 3/20 0.36
KDM4E B2RXH2 1/20 0.36
CASP1 P29466 1/20 0.36

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
SCHEMBL1953246 0.76 PNMT (0.44) ALDH1A1POLBDRD2
SCHEMBL3995514 0.76 KMT2A (0.41) MEN1KMT2AALDH1A1MAPTRAB9A
SCHEMBL1951737 0.74 HDAC3 (0.39) ALDH1A1DRD2KDM4E
SCHEMBL1950206 0.73 KDM4E (0.38) MEN1KMT2AALDH1A1POLBPRMT5
SCHEMBL1953429 0.73 CARM1 (0.45) MEN1KMT2APRMT5WDR77
SCHEMBL697852 0.73 KMT2A (0.41) MEN1KMT2ARAB9AKDM4E
SCHEMBL8470925 0.73 ADRA1D (0.42) MAPTDRD2KDM4E
SCHEMBL1950288 0.72 DRD2 (0.45) MEN1KMT2AALDH1A1RAB9AGFER
SCHEMBL5411176 0.71 ALDH1A1 (0.43) MEN1KMT2AALDH1A1PRMT5WDR77
SCHEMBL3486703 0.71 NOTUM (0.63) MEN1KMT2AALDH1A1MAPTRAB9A

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-8399454-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2013-03-19 US claimed
US-20110015170-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2011-01-20 US claimed
US-8722658-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2014-05-13 US disclosed
US-20130137674-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA, NV (US) 2013-05-30 US disclosed
US-8399454-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2013-03-19 US disclosed
US-20110015170-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2011-01-20 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 (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-20110015170-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, LIPA MEN1 1953/4885KMT2A 1573/4885ALDH1A1 364/4885
US-20130137674-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, LIPA MEN1 1953/4885KMT2A 1573/4885ALDH1A1 364/4885

“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.