SCHEMBL6209213

SCHEMBL6209213

CC(C)CN=C1C=CC(=Nc2ccccc2)C=C1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
MPI P34949 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
KCNA3 P22001 1/20 0.31

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
SCHEMBL6209034 0.79 LMNA (0.34) ALDH1A1KDM4EMEN1MAPTMPI
SCHEMBL755432 0.77 ALDH1A1 (0.47) ALDH1A1KDM4EMEN1MAPTMPI
SCHEMBL6210004 0.76 LMNA (0.33) ALDH1A1KDM4EMEN1MAPTMPI
SCHEMBL1241941 0.75 ALDH1A1 (0.31) ALDH1A1LMNAMAPK1
SCHEMBL7093744 0.75 ALDH1A1 (0.33) ALDH1A1KDM4EMEN1MAPTMPI
SCHEMBL6817759 0.74 LMNA (0.32) ALDH1A1LMNAKCNA3
SCHEMBL6209087 0.73 HTR5A (0.35) MEN1KMT2ALMNAMAPK1HTT
SCHEMBL6208646 0.73 LMNA (0.33) ALDH1A1MEN1KMT2ALMNAMAPK1
SCHEMBL6208563 0.71 KCNA3 (0.37) MEN1KMT2AMAPK1KCNA3
SCHEMBL6208251 0.71 ALDH1A1 (0.38) ALDH1A1KDM4EMEN1MAPTMPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9090526-B2 Synergistic combination for inhibiting polymerization of vinyl monomers NALCO COMPANY (US) 2015-07-28 US claimed
EP-1305279-B1 POLYMERIZATION INHIBITOR FOR VINYL-CONTAINING MATERIALS GE BETZ INC (US) 2005-02-23 EP claimed
JP-2004504369-A 2004-02-12 JP claimed
EP-1228162-B1 METHODS AND COMPOSITIONS FOR INHIBITING VINYL AROMATIC MONOMER POLYMERIZATION BAKER HUGHES INC (US) 2003-11-19 EP claimed
US-6592722-B2 Comprising a quinone diimide compound and a nitroxyl compound GE BETZ, INC. 2003-07-15 US claimed
EP-1305279-A2 POLYMERIZATION INHIBITOR FOR VINYL-CONTAINING MATERIALS GE Betz, Inc. (US) 2003-05-02 EP claimed
US-20030030035-A1 Polymerization inhibitor for vinyl-containing materials GE BETZ, INC. 2003-02-13 US claimed
WO-2002008161-A2 POLYMERIZATION INHIBITOR FOR VINYL-CONTAINING MATERIALS HERCULES INCORPORATED (US) 2002-01-31 WO claimed
US-6342648-B1 METHYLENEBISPHENOL AND OXIDIZED PHENYLENEDIAMINE BENZOQUINONEDIIMIDE COMPOUNDS AS POLYMERIZATION INHIBITORS BAKER HUGHES INCORPORATED 2002-01-29 US claimed
EP-2726451-B1 SYNERGISTIC COMBINATION FOR INHIIBITING POLYMERIZATION OF VINYL MONOMERS NALCO CO (US) 2017-03-22 EP disclosed
US-9090526-B2 Synergistic combination for inhibiting polymerization of vinyl monomers NALCO COMPANY (US) 2015-07-28 US disclosed
US-20120316369-A1 SYNERGISTIC COMBINATION FOR INHIIBITING POLYMERIZATION OF VINYL MONOMERS ECOLAB USA INC. 2012-12-13 US disclosed
EP-1305279-B1 POLYMERIZATION INHIBITOR FOR VINYL-CONTAINING MATERIALS GE BETZ INC (US) 2005-02-23 EP disclosed
EP-1228162-B1 METHODS AND COMPOSITIONS FOR INHIBITING VINYL AROMATIC MONOMER POLYMERIZATION BAKER HUGHES INC (US) 2003-11-19 EP disclosed
EP-1228162-A1 METHODS AND COMPOSITIONS FOR INHIBITING VINYL AROMATIC MONOMER POLYMERIZATION BAKER HUGHES INCORPORATED (US) 2002-08-07 EP disclosed
WO-2002008161-A2 POLYMERIZATION INHIBITOR FOR VINYL-CONTAINING MATERIALS HERCULES INCORPORATED (US) 2002-01-31 WO disclosed
US-6342648-B1 METHYLENEBISPHENOL AND OXIDIZED PHENYLENEDIAMINE BENZOQUINONEDIIMIDE COMPOUNDS AS POLYMERIZATION INHIBITORS BAKER HUGHES INCORPORATED 2002-01-29 US disclosed
WO-2001023499-A1 METHODS AND COMPOSITIONS FOR INHIBITING VINYL AROMATIC MONOMER POLYMERIZATION BAKER HUGHES INCORPORATED (US) 2001-04-05 WO disclosed
US-5562863-A UTILIZING 2,6-DI-TERT-BUTYL-4-METHYLPHENOL AND SUBSTITUTED BENZOQUINONEDIIMIDE TO PREVENT STYRENE POLYMERIZATION BETZ LABORATORIES, INC. (US) 1996-10-08 US disclosed
US-5470440-A 2,6-di-tert-butyl-4-methylphenol and a substituted benzoquinonediimide BETZ LABORATORIES, INC. (US) 1995-11-28 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-20120316369-A1 SYNERGISTIC COMBINATION FOR INHIIBITING POLYMERIZATION OF VINYL MONOMERS QDPR, SDHA, BLVRB ALDH1A1 613/4885KDM4E 1990/4885MEN1 2011/4885

“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.