SCHEMBL6526697

SCHEMBL6526697

COC(=O)C(=Cc1ccccc1)C(C)=O

nearest known ligand 0.85

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
MAPT P10636 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
RECQL P46063 1/20 0.51
HTT P42858 1/20 0.50
ALDH1A1 P00352 1/20 0.50
GLA P06280 1/20 0.50
POLB P06746 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
AKR1C3 P42330 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
SCHEMBL6526695 1.00 MEN1 (0.56) MEN1KMT2AMAPTSMN1; SMN2RECQL
SCHEMBL15026365 1.00 MEN1 (0.56) MEN1KMT2AMAPTSMN1; SMN2RECQL
SCHEMBL77732 0.92 MEN1 (0.63) MEN1KMT2AMAPTHTTAKR1C3
SCHEMBL3430755 0.87 MEN1 (0.58) MEN1KMT2AMAPTHTTAKR1C3
SCHEMBL6005632 0.87 MEN1 (0.58) MEN1KMT2AMAPTHTTAKR1C3
SCHEMBL11772807 0.85 MEN1 (0.56) MEN1KMT2AMAPTHTTAKR1C3
SCHEMBL979463 0.84 ALDH1A1 (0.67) MEN1KMT2AMAPTSMN1; SMN2RECQL
SCHEMBL13552273 0.84 MAPT (0.56) MEN1KMT2AMAPT
SCHEMBL28273258 0.84 AKR1C3 (0.61) MEN1KMT2AMAPTSMN1; SMN2RECQL
SCHEMBL9401645 0.84 KDM4E (0.52) MEN1KMT2AMAPTALDH1A1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130018049-A1 Azaindole Compounds and Methods for Treating HIV GLAXOSMITHKLINE LLC (US) 2013-01-17 US disclosed
US-20050209117-A1 Complexing agent for treating metallic and plastic surfaces BASF AKTIENGESELLSCHAFT (DE) 2005-09-22 US disclosed
EP-1023267-B1 PYRIDYL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CERMOL SA (CH) 2003-09-17 EP disclosed
US-6482841-B1 Pyridyl compounds and pharmaceutical compositions containing them CERMOL S.A. (CH) 2002-11-19 US disclosed
EP-1023267-A1 PYRIDYL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CERMOL S.A. (CH) 2000-08-02 EP disclosed
US-5951841-A ACIDIC ELECTROPLATING BATHS COMPRISING BRIGHTENERS FOR THE ELECTROLYTIC DEPOSITION OF METALLIC INORGANIC LAYERS ONTO SHAPED ARTICLES BASF AKTIENGESELLSCHAFT (DE) 1999-09-14 US disclosed
WO-1999019302-A1 PYRIDYL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CERMOL S.A. (CH) 1999-04-22 WO disclosed
US-5421990-A An acidic aqueous electrodeposition bath having a nontoxic, nonirritating brightener comprising a benzylidine malonic ester or acetylacetonate BASF AKTIENGESELLSCHAFT (DE) 1995-06-06 US disclosed
CN-1010947-B PROCESS FOR PREPN. OF PYRIDOPYRIMIDINES COMPOUNDS BAYER AG (DE) 1990-12-26 CN disclosed
EP-0381699-A1 ALKYLENE AND DIALKYL KETALS AND ALKYL ALPHA-ENOL ETHERS OF ALPHA-ACETYL CINNAMIC ACIDS AND ESTERS THEREOF EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1990-08-16 EP disclosed
US-3951994-A HYPOTENSIVE, CORONARY VESSEL DILATORS BAYER AKTIENGESELLSCHAFT (DT) 1976-04-20 US disclosed
US-3951988-A HYPOTENSIVE, CORONARY VESSEL DILATORS BAYER AKTIENGESELLSCHAFT (DT) 1976-04-20 US disclosed
US-3948923-A HYPOTENSIVE, VASODILATION BAYER AKTIENGESELLSCHAFT (DT) 1976-04-06 US disclosed
US-3946026-A HYPOTENSIVE AGENTS, CORONARY VESSEL DILATORS BAYER AKTIENGESELLSCHAFT (DT) 1976-03-23 US disclosed
US-3946028-A HYPOTENSIVE AGENTS, CORONARY VESSEL DILATORS BAYER AKTIENGESELLSCHAFT (DT) 1976-03-23 US disclosed
US-3946027-A HYPOTENSIVE AGENTS, CORONARY VESSEL DILATORS BAYER AKTIENGESELLSCHAFT (DT) 1976-03-23 US disclosed
US-3943140-A HYPOTENSIVE, VASODILATION BAYER AKTIENGESELLSCHAFT (DT) 1976-03-09 US disclosed
US-3939171-A HYPOTENSIVE, VASODILATION BAYER AKTIENGESELLSCHAFT (DT) 1976-02-17 US disclosed
US-3935220-A VASODILATION, HYPOTENSIVE BAYER AKTIENGESELLSCHAFT (DT) 1976-01-27 US disclosed
US-3935223-A 2-Amino-1,4-dihydropyridine derivatives BAYER AKTIENGESELLSCHAFT (DT) 1976-01-27 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 (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-20130018049-A1 Azaindole Compounds and Methods for Treating HIV AZI2, TPMT, INMT MEN1 3932/4885KMT2A 298/4885MAPT 1502/4885

“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.