SCHEMBL10033800

SCHEMBL10033800

C#CCN(C)Cc1ccc(C(=O)NC(Cc2ccccc2)C(=O)OCC)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.53
▸ GAA P10253 1/20 0.53
▸ PTPN1 P18031 2/20 0.53
▸ PYCR1 P32322 3/20 0.50
▸ CTSL P07711 1/20 0.49
▸ LMNA P02545 2/20 0.49
▸ USP2 O75604 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ MAOA P21397 1/20 0.49
▸ MAOB P27338 1/20 0.49
▸ EPHX2 P34913 1/20 0.48
▸ PPARG P37231 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ BLM P54132 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ CTSG P08311 2/20 0.47
▸ TP53 P04637 1/20 0.46
▸ CMA1 P23946 1/20 0.46

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
SCHEMBL10033802 0.88 PTPN1 (0.68) RAB9APTPN1PYCR1CTSLLMNA
SCHEMBL28790851 0.81 CTSL (0.71) RAB9AGAACTSLLMNAEPHX2
SCHEMBL3927028 0.81 CTSL (0.71) RAB9AGAACTSLLMNAEPHX2
SCHEMBL31156814 0.80 GAA (0.65) RAB9AGAAPTPN1CTSLLMNA
SCHEMBL27761117 0.78 CTSL (0.62) RAB9AGAACTSLLMNAEPHX2
SCHEMBL3935180 0.77 CTSL (0.62) RAB9AGAACTSLLMNATSHR
SCHEMBL1796825 0.77 CTSL (0.62) RAB9AGAACTSLLMNATSHR
SCHEMBL30064651 0.77 CTSL (0.62) RAB9AGAACTSLLMNATSHR
SCHEMBL1784498 0.77 CTSL (0.62) RAB9AGAACTSLLMNATSHR
SCHEMBL31156806 0.76 GAA (0.62) RAB9AGAACTSLEPHX2PPARG

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-8124802-B2 e.g. N-methyl-N-propargyl-4-hydroxybenzyl amine; monoamine oxidase inhibitors; are mediated via a peripheral (i.e., non-CNS) mechanism; antidiabetic agent, metabolic disordes, obesity, insulin resistance JENRIN DISCOVERY, INC. (US) 2012-02-28 — — US disclosed
US-20080182824-A1 MAO INHIBITING N-BENZYL-N-PROPARGYL-AMINES USEFUL FOR TREATING OBESITY JENRIN DISCOVERY (US) 2008-07-31 — — 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-20080182824-A1 MAO INHIBITING N-BENZYL-N-PROPARGYL-AMINES USEFUL FOR TREATING OBESITY MAOA, MAOB, PNMT RAB9A 1714/4885GAA 78/4885PTPN1 2646/4885

“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.

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