SCHEMBL4908980

SCHEMBL4908980

O=C(Cc1ccccc1)Nc1ccccn1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.82
▸ MEN1 O00255 1/20 0.82
▸ SLC6A2 P23975 1/20 0.82
▸ SLC6A3 Q01959 1/20 0.82
▸ GAA P10253 2/20 0.71
▸ ALDH1A1 P00352 2/20 0.68
▸ DEGS1 O15121 1/20 0.65
▸ SMN1; SMN2 Q16637 2/20 0.64
▸ NPC1 O15118 2/20 0.64
▸ RAB9A P51151 2/20 0.64
▸ POLB P06746 3/20 0.61
▸ ESR1 P03372 1/20 0.61
▸ STAT3 P40763 1/20 0.61
▸ ESR2 Q92731 1/20 0.61
▸ HSD17B10 Q99714 2/20 0.60
▸ CYP1A2 P05177 1/20 0.60
▸ PKM P14618 1/20 0.59
▸ HDAC3 O15379 2/20 0.59
▸ HDAC4 P56524 2/20 0.59
▸ HDAC1 Q13547 2/20 0.59

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
Difenpiramide SCHEMBL29238669 0.91 KMT2A (1.00) KMT2AMEN1SLC6A2SLC6A3GAA
Difenpiramide SCHEMBL23833 0.91 KMT2A (1.00) KMT2AMEN1SLC6A2SLC6A3GAA
SCHEMBL6490488 0.87 KMT2A (0.74) KMT2AMEN1SLC6A2SLC6A3GAA
SCHEMBL29270879 0.87 KMT2A (1.00) KMT2AMEN1SLC6A2SLC6A3GAA
SCHEMBL19555122 0.87 KMT2A (0.77) KMT2AMEN1SLC6A2SLC6A3GAA
SCHEMBL2815739 0.86 KMT2A (0.63) KMT2AMEN1SLC6A2SLC6A3GAA
SCHEMBL28194116 0.84 KMT2A (0.68) KMT2AMEN1SLC6A2SLC6A3GAA
SCHEMBL4575591 0.84 KMT2A (0.68) KMT2AMEN1SLC6A2SLC6A3GAA
SCHEMBL6245092 0.83 GAA (1.00) KMT2AMEN1SLC6A2SLC6A3GAA
SCHEMBL7776518 0.83 GAA (0.83) KMT2AMEN1SLC6A2SLC6A3GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2536721-A1 PYRAZOLO PIPERIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GenKyoTex SA (CH) 2012-12-26 — — EP claimed
EP-0815108-A1 CYCLIC UREA HIV PROTEASE INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1998-01-07 — — EP claimed
CN-119143757-A Synthesis method of 3-benzyl imidazo [1,5-a ] pyridine-1-carboxylic acid ethyl ester 南通大学 2024-12-17 — — CN disclosed
CN-110252351-B Application of copper catalyst in catalyzing reaction of 1-pyridyl indole compound and tert-butyl nitrite 苏州大学 2021-12-10 — — CN disclosed
EP-2467137-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2012-06-27 — — EP disclosed
US-20080269494-A1 Process for the Preparation of Alpha-Aryl-Alpha-Piperid-2-Yl-Acetamides and the Acid Hydrolysis Thereof ARCHIMICA S.R.L. (IT) 2008-10-30 — — US disclosed
EP-1868996-A1 A PROCESS FOR THE PREPARATION OF ALPHA-ARYL-ALPHA-PIPERID-2-YL-ACETAMIDES AND THE ACID HYDROLYSIS THEREOF Archimica S.r.l. (IT) 2007-12-26 — — EP disclosed
WO-2006064052-A1 A PROCESS FOR THE PREPARATION OF ALPHA-ARYL-ALPHA-PIPERID-2-YL-ACETAMIDES AND THE ACID HYDROLYSIS THEREOF ARCHIMICA S.R.L. (IT) 2006-06-22 — — 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-20080269494-A1 Process for the Preparation of Alpha-Aryl-Alpha-Piperid-2-Yl-Acetamides and the Acid Hydrolysis Thereof ADRA2A, ARSA, CYP1A2 KMT2A 133/4885MEN1 4436/4885SLC6A2 388/4885

“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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