SCHEMBL2397616

SCHEMBL2397616

CCN(C(=O)CC1CCN(C)CC1)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
FFAR1 O14842 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37
CHRM3 P20309 4/20 0.36
CACNA1I Q9P0X4 4/20 0.36
KCNH2 Q12809 2/20 0.36
ACHE P22303 1/20 0.36
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
Fumaric Acid SCHEMBL1935961 0.93 HRH1 (0.38) POLBFFAR1FFAR4CHRM3ACHE
SCHEMBL2395522 0.88 CYP1A2 (0.46) OPRM1OPRD1OPRK1MEN1KMT2A
SCHEMBL2396182 0.87 CYP3A4 (0.44) OPRM1
SCHEMBL2395603 0.84 CCR5 (0.41) CHRM3OPRM1OPRD1OPRK1
SCHEMBL2396379 0.83 SLC6A2 (0.40) CHRM3
Hydrochloric Acid SCHEMBL2396854 0.83 OPRM1 (0.41) CHRM3OPRM1OPRD1OPRK1
Fumaric Acid SCHEMBL2396810 0.82 CYP1A2 (0.42) ACHEOPRM1OPRD1OPRK1MEN1
SCHEMBL1934810 0.81 PGR (0.39) ACHEOPRM1OPRD1OPRK1MEN1
SCHEMBL1936307 0.81 PGR (0.36) ACHEOPRM1OPRD1OPRK1
Fumaric Acid SCHEMBL1936259 0.81 HRH1 (0.44)

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-20110212997-A1 PIPERIDINE-4-ACETAMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2011-09-01 US claimed
US-20110212997-A1 PIPERIDINE-4-ACETAMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2011-09-01 US disclosed
WO-2010023197-A2 NOVEL PIPERIDINE-4-ACETAMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2010-03-04 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-20110212997-A1 PIPERIDINE-4-ACETAMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS SLC18A2, SLC6A2, SLC18A3 POLB 1801/4885FFAR1 1736/4885FFAR4 1375/4885

“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.