SCHEMBL14877286

SCHEMBL14877286

O=C(c1ccc(-c2cccc(C(F)(F)F)c2)cc1)N1CCC(C2CN(C(=O)c3nccs3)C2)CC1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A7 Q99884 4/20 0.56
RBP4 P02753 1/20 0.49
ABL1 P00519 2/20 0.46
BCR P11274 2/20 0.46
UBE2M P61081 2/20 0.46
DCUN1D1 Q96GG9 2/20 0.46
MGLL Q99685 7/20 0.45
ADAMTS7 Q9UKP4 1/20 0.44
ADAMTS5 Q9UNA0 1/20 0.44
GHSR Q92847 1/20 0.43
SPR P35270 1/20 0.42
HSD11B1 P28845 1/20 0.42
FAAH O00519 1/20 0.42

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
SCHEMBL10175214 1.00 SLC6A7 (0.56) SLC6A7RBP4ABL1BCRUBE2M
SCHEMBL912124 0.88 SLC6A7 (0.59) SLC6A7ABL1BCRMGLLFAAH
SCHEMBL10175622 0.87 GPR52 (0.51) SLC6A7RBP4ABL1BCRUBE2M
SCHEMBL2130865 0.87 SLC6A7 (0.52) SLC6A7RBP4ABL1BCRUBE2M
SCHEMBL14877287 0.87 GPR52 (0.51) SLC6A7RBP4ABL1BCRUBE2M
SCHEMBL10175842 0.87 SLC6A7 (0.57) SLC6A7RBP4ABL1BCRMGLL
SCHEMBL14877263 0.85 RBP4 (0.50) SLC6A7RBP4ABL1BCRMGLL
SCHEMBL14877213 0.83 RBP4 (0.49) SLC6A7RBP4MGLLHSD11B1FAAH
SCHEMBL14877065 0.82 SLC6A7 (0.54) SLC6A7ABL1BCRUBE2MDCUN1D1
SCHEMBL14877295 0.82 SLC6A7 (0.54) SLC6A7ABL1BCRUBE2MDCUN1D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130244998-A1 PIPERIDIN-4-YL-AZETIDINE DIAMIDES AS MONOACYLGLCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA, NV (BE) 2013-09-19 US disclosed
US-8513423-B2 Piperidin-4-yl-azetidine diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2013-08-20 US disclosed
US-20130102584-A1 PIPERIDIN-4-YL-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA, NV (BE) 2013-04-25 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-20130102584-A1 PIPERIDIN-4-YL-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, MGLL SLC6A7 1612/4885RBP4 3666/4885ABL1 145/4885
US-20130244998-A1 PIPERIDIN-4-YL-AZETIDINE DIAMIDES AS MONOACYLGLCEROL LIPASE INHIBITORS MGLL, PNLIP, LPL SLC6A7 2321/4885RBP4 3301/4885ABL1 258/4885

“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.