SCHEMBL2707877

SCHEMBL2707877

COc1ccc2[nH]c3c(c2c1)CCN(C(C)=O)C3C

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 6/20 0.62
MAPT P10636 4/20 0.59
TP53 P04637 4/20 0.59
SIRT1 Q96EB6 2/20 0.56
MAPKAPK5 Q8IW41 1/20 0.56
BAZ2B Q9UIF8 1/20 0.56
ALDH1A1 P00352 1/20 0.55
HTR2B P41595 1/20 0.55
ABCG2 Q9UNQ0 2/20 0.54
KDR P35968 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.52
ABCB1 P08183 1/20 0.50

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
SCHEMBL15241465 0.91 MAPT (0.55) MAPKAPK2MAPTTP53ALDH1A1ABCG2
SCHEMBL8025885 0.88 MAPKAPK2 (0.56) MAPKAPK2MAPTTP53SIRT1MAPKAPK5
SCHEMBL9401140 0.88 MAPKAPK2 (0.61) MAPKAPK2MAPTTP53SIRT1MAPKAPK5
SCHEMBL8025879 0.88 MAPKAPK2 (0.59) MAPKAPK2MAPTTP53SIRT1MAPKAPK5
SCHEMBL6242196 0.87 MAPKAPK2 (0.58) MAPKAPK2MAPTTP53SIRT1MAPKAPK5
SCHEMBL998246 0.85 MAPKAPK2 (0.59) MAPKAPK2MAPTTP53SIRT1MAPKAPK5
SCHEMBL6243057 0.85 MAPKAPK2 (0.65) MAPKAPK2MAPTTP53SIRT1MAPKAPK5
SCHEMBL8036166 0.84 MAPKAPK2 (0.58) MAPKAPK2MAPTTP53SIRT1MAPKAPK5
SCHEMBL9401138 0.84 MAPKAPK2 (0.59) MAPKAPK2MAPTTP53SIRT1MAPKAPK5
SCHEMBL9401154 0.83 MAPKAPK2 (0.61) MAPKAPK2MAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240043422-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC. (US) 2024-02-08 US disclosed
US-11613538-B2 Method of inhibiting or reducing a viral infection PTC THERAPEUTICS, INC. (US) 2023-03-28 US disclosed
EP-2434891-B9 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS INC (US) 2021-05-05 EP disclosed
US-20200317668-A1 METHOD OF INHIBITING OR REDUCING A CORONAVIRIDAE VIRUS INFECTION PTC THERAPEUTICS, INC. 2020-10-08 US disclosed
EP-3718405-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC Therapeutics, Inc. (US) 2020-10-07 EP disclosed
EP-2434891-B1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS INC (US) 2020-07-22 EP disclosed
US-20190194188-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC. 2019-06-27 US disclosed
US-20160340354-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC. 2016-11-24 US disclosed
US-9351964-B2 Methods for treating cancer and non-neoplastic conditions PTC THERAPEUTICS, INC. (US) 2016-05-31 US disclosed
US-8703726-B2 Methods for treating prostate conditions PTC THERAPEUTICS, INC. (US) 2014-04-22 US disclosed
WO-2010138695-A1 METHODS FOR TREATING NEUROFIBROMATOSIS PTC THERAPEUTICS, INC. (US) 2010-12-02 WO disclosed
WO-2007101863-A1 THERAPEUTIC COMBINATION OF A 5HT2 RECEPTOR ANTAGONIST AND OF A 5HT2 RECEPTOR ACTIVATOR MACEF (FR) 2007-09-13 WO disclosed
EP-1091959-B1 NOVEL PYRROLO-(3,4-B)QUINOLINE DERIVATIVES, METHOD FOR THE PRODUCTION AND USE THEREOF AS A MEDICAMENT MACEF (FR) 2002-10-23 EP disclosed
US-6335346-B1 HYPNOTIC AGENTS, SEDATIVES MACEF (FR) 2002-01-01 US disclosed
US-6048868-A CIRCADIAN RHYTHM DISORDERS; SLEEP DISORDERS; ANTIDEPRESSANTS CEMAF (FR) 2000-04-11 US disclosed
EP-0781281-A1 NOVEL MELATONIN AGONIST $g(b)-CARBOLINE DERIVATIVES AND ANALOGS WITH A NAPHTHALENIC STRUCTURE, METHOD FOR THEIR PREPARATION AND THEIR USE AS DRUGS CEMAF (FR) 1997-07-02 EP disclosed
WO-1996008490-A1 NOVEL MELATONIN AGONIST β-CARBOLINE DERIVATIVES AND ANALOGS WITH A NAPHTHALENIC STRUCTURE, METHOD FOR THEIR PREPARATION AND THEIR USE AS DRUGS CEMAF (FR) 1996-03-21 WO disclosed
US-5314908-A Compounds useful as antiproliferative agents WHITBY RESEARCH, INC. (US) 1994-05-24 US disclosed
EP-0549916-A2 Compounds useful as antiproliferative agents WHITBY RESEARCH, Inc. (US) 1993-07-07 EP disclosed
US-5206377-A Compounds useful as antiproliferative agents WHITBY RESEARCH, INC. (US) 1993-04-27 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 (5 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-20240043422-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA MAPKAPK2 2851/4885MAPT 3300/4885TP53 15/4885
US-20160340354-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA MAPKAPK2 2893/4885MAPT 3328/4885TP53 16/4885
US-20190194188-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA MAPKAPK2 2893/4885MAPT 3328/4885TP53 16/4885
US-20200317668-A1 METHOD OF INHIBITING OR REDUCING A CORONAVIRIDAE VIRUS INFECTION SARS1, POLRMT, EIF2AK2 MAPKAPK2 3046/4885MAPT 2964/4885TP53 1818/4885
US-11613538-B2 Method of inhibiting or reducing a viral infection SARS1, EIF2AK2, POLRMT MAPKAPK2 2957/4885MAPT 2901/4885TP53 1710/4885

“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.