SCHEMBL608164

SCHEMBL608164

COc1ccc2[nH]c3c(c2c1)CCNC3C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 18/20 1.00
MAPKAPK5 Q8IW41 1/20 1.00
ALDH1A1 P00352 1/20 0.67
MAPT P10636 1/20 0.67
HTR2B P41595 1/20 0.67
SIRT1 Q96EB6 1/20 0.64

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
SCHEMBL12660570 1.00 MAPKAPK2 (1.00) MAPKAPK2MAPKAPK5ALDH1A1MAPTHTR2B
SCHEMBL6235224 1.00 MAPKAPK2 (1.00) MAPKAPK2MAPKAPK5ALDH1A1MAPTHTR2B
SCHEMBL6352708 1.00 MAPKAPK2 (1.00) MAPKAPK2MAPKAPK5ALDH1A1MAPTHTR2B
SCHEMBL6239907 0.90 MAPKAPK2 (0.82) MAPKAPK2MAPKAPK5ALDH1A1MAPTHTR2B
SCHEMBL1491372 0.89 MAPKAPK2 (1.00) MAPKAPK2MAPKAPK5ALDH1A1MAPTHTR2B
SCHEMBL6239836 0.89 MAPKAPK2 (0.80) MAPKAPK2MAPKAPK5ALDH1A1MAPTHTR2B
Hydrochloric Acid SCHEMBL6358190 0.89 MAPKAPK2 (0.80) MAPKAPK2MAPKAPK5ALDH1A1MAPTHTR2B
Hydrochloric Acid SCHEMBL6352215 0.88 MAPKAPK2 (0.98) MAPKAPK2MAPKAPK5ALDH1A1MAPTHTR2B
SCHEMBL6241595 0.88 MAPKAPK2 (0.79) MAPKAPK2MAPKAPK5ALDH1A1MAPTHTR2B
SCHEMBL6241157 0.87 MAPKAPK2 (1.00) MAPKAPK2MAPKAPK5ALDH1A1MAPTHTR2B

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 350 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10751330-B2 Human therapeutic agents ANKH LIFE SCIENCES LIMITED (IE) 2020-08-25 US claimed
US-20200147061-A1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LIMITED (IE) 2020-05-14 US claimed
US-10092550-B2 Therapeutic compositions containing curcumin, harmine, and isovanillin components, and methods of use thereof IONS PHARMACEUTICAL S.À R.L. (LU) 2018-10-09 US claimed
US-20170105975-A1 THERAPEUTIC COMPOSITIONS CONTAINING HARMINE AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF IONS PHARMACEUTICAL S.À R.L. (LU) 2017-04-20 US claimed
US-20170042865-A1 THERAPEUTIC COMPOSITIONS CONTAINING CURCUMIN, HARMINE, AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF IONS PHARMACEUTICAL S.À R.L. (LU) 2017-02-16 US claimed
US-20080187572-A1 Matrix Metalloproteinase Inhibitors of Tgfb-Induced Subcapsular Cataract Formation MCMASTER UNIVERSITY (CA) 2008-08-07 US claimed
US-20050137220-A1 Beta-carboline compounds and analogues thereof as mitogen-activated protein kinase-activated protein kinase-2 inhibitors PHARMACIA CORPORATION (US) 2005-06-23 US claimed
EP-0891187-B1 USE OF DERIVATIVES OF TETRAHYDRO-BETA-CARBOLINES AS ANTIMETASTATIC AGENTS HOFFMANN LA ROCHE (CH) 2002-01-30 EP claimed
US-6069150-A METALLOPROTRINASE INHIBITOR F. HOFFMAN-LA ROCHE AG (CH) 2000-05-30 US claimed
EP-0891187-A1 USE OF DERIVATIVES OF TETRAHYDRO-BETA-CARBOLINES AS ANTIMETASTATIC AGENTS F. HOFFMANN-LA ROCHE AG (CH) 1999-01-20 EP claimed
WO-1997037658-A1 USE OF DERIVATIVES OF TETRAHYDRO-BETA-CARBOLINES AS ANTIMETASTATIC AGENTS F.HOFFMANN-LA ROCHE AG (CH) 1997-10-16 WO claimed
US-20250255853-A1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LIMITED (IE) 2025-08-14 US disclosed
EP-3965738-B1 METHOD FOR PRODUCTION OF LIPOSOMES UNIV DO MINHO (PT) 2025-08-06 EP disclosed
US-20240390294-A1 INHIBITION OF COVID-19 VIRUS BY MULTIPLE-COMPONENT FORMULATIONS ANKH LIFE SCIENCES LIMITED (IE) 2024-11-28 US disclosed
US-20240285592-A1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LIMITED (IE) 2024-08-29 US disclosed
WO-2004060346-A2 DRUG DELIVERY FROM RAPID GELLING POLYMER COMPOSITION ANGIOTECH INTERNATIONAL AG (CH) 2004-07-22 WO disclosed
WO-2004060405-A2 TISSUE REACTIVE COMPOUNDS AND COMPOSITIONS AND USES THEREOF ANGIOTECH INTERNATIONAL AG (CH) 2004-07-22 WO disclosed
WO-2004060424-A2 SILK-CONTAINING STENT GRAFT ANGIOTECH INTERNATIONAL AG (CH) 2004-07-22 WO disclosed
EP-0891187-B1 USE OF DERIVATIVES OF TETRAHYDRO-BETA-CARBOLINES AS ANTIMETASTATIC AGENTS HOFFMANN LA ROCHE (CH) 2002-01-30 EP disclosed
US-6069150-A METALLOPROTRINASE INHIBITOR F. HOFFMAN-LA ROCHE AG (CH) 2000-05-30 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 (9 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-20050137220-A1 Beta-carboline compounds and analogues thereof as mitogen-activated protein kinase-activated protein kinase-2 inhibitors MAPKAPK2, MAP4K2, MAP3K2 MAPKAPK2 1/4885MAPKAPK5 34/4885ALDH1A1 4386/4885
US-10751330-B2 Human therapeutic agents INMT, HNMT, HASPIN MAPKAPK2 3624/4885MAPKAPK5 3577/4885ALDH1A1 371/4885
US-20240285592-A1 HUMAN THERAPEUTIC AGENTS INMT, NLN, MYC MAPKAPK2 3175/4885MAPKAPK5 3524/4885ALDH1A1 1257/4885
US-20170042865-A1 THERAPEUTIC COMPOSITIONS CONTAINING CURCUMIN, HARMINE, AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF INMT, HNMT, CPT1A MAPKAPK2 3520/4885MAPKAPK5 3279/4885ALDH1A1 460/4885
US-10092550-B2 Therapeutic compositions containing curcumin, harmine, and isovanillin components, and methods of use thereof INMT, HNMT, CPT1A MAPKAPK2 3520/4885MAPKAPK5 3279/4885ALDH1A1 460/4885
US-20170105975-A1 THERAPEUTIC COMPOSITIONS CONTAINING HARMINE AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF INMT, HNMT, COMT MAPKAPK2 3472/4885MAPKAPK5 3040/4885ALDH1A1 320/4885
US-20200147061-A1 HUMAN THERAPEUTIC AGENTS INMT, HNMT, HASPIN MAPKAPK2 3624/4885MAPKAPK5 3577/4885ALDH1A1 371/4885
US-20250255853-A1 HUMAN THERAPEUTIC AGENTS HASPIN, TIPARP, SHARPIN MAPKAPK2 3119/4885MAPKAPK5 3238/4885ALDH1A1 1381/4885
US-20240390294-A1 INHIBITION OF COVID-19 VIRUS BY MULTIPLE-COMPONENT FORMULATIONS MAVS, IDO2, IDO1 MAPKAPK2 2904/4885MAPKAPK5 3469/4885ALDH1A1 1371/4885

“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.