SCHEMBL4674769

SCHEMBL4674769

COc1cc(CCl)ccc1NC(=O)Nc1ccccc1C

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
GAA P10253 1/20 0.57
ITGB1 P05556 8/20 0.57
ITGA4 P13612 8/20 0.57
MAPT P10636 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
LPAR1 Q92633 2/20 0.51
GFER P55789 1/20 0.49
DDX3X O00571 1/20 0.49
POLB P06746 1/20 0.48

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
SCHEMBL4675624 0.88 MEN1 (0.59) MEN1KMT2AGAAITGB1ITGA4
SCHEMBL14222078 0.88 MEN1 (0.59) MEN1KMT2AGAAITGB1ITGA4
SCHEMBL5701006 0.86 ITGA4 (0.61) MEN1KMT2AGAAITGB1ITGA4
SCHEMBL14500970 0.86 MEN1 (0.56) MEN1KMT2AGAAITGB1ITGA4
SCHEMBL4683165 0.86 ITGA4 (0.67) MEN1KMT2AGAAITGB1ITGA4
SCHEMBL6597529 0.86 MEN1 (0.56) MEN1KMT2AITGB1ITGA4MAPT
SCHEMBL5274777 0.85 MEN1 (0.55) MEN1KMT2AGAAITGB1ITGA4
SCHEMBL6136413 0.84 ITGB1 (0.66) MEN1KMT2AGAAITGB1ITGA4
SCHEMBL5852144 0.82 LPAR1 (0.71) MEN1KMT2AGAAMAPTSMN1; SMN2
SCHEMBL7868788 0.82 ITGB1 (0.60) MEN1KMT2AGAAITGB1ITGA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1414444-B1 NOVEL IMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS VLA-4 ANTAGONISTS SANOFI AVENTIS DEUTSCHLAND (DE) 2008-04-09 EP disclosed
EP-1381595-B1 BIS(TRIFLUOROMETHYL)HYDANTOINS AS INTERMEDIATES FOR PHARMACEUTICALLY ACTIVE INGREDIENTS SANOFI AVENTIS DEUTSCHLAND (DE) 2007-08-08 EP disclosed
US-6962937-B2 Imidazolidine derivatives, their preparation and their use AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-11-08 US disclosed
EP-1373249-B1 IMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION, AND THEIR USE AS ANTIINFLAMATORY AGENT AVENTIS PHARMA GMBH (DE) 2005-04-20 EP disclosed
US-6794517-B2 AS CHEMICAL INTERMEDIATE TO FORM DRUGS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-09-21 US disclosed
EP-1414444-A1 NOVEL IMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS VLA-4 ANTAGONISTS Aventis Pharma Deutschland GmbH (DE) 2004-05-06 EP disclosed
EP-1381595-A1 BIS(TRIFLUOROMETHYL)HYDANTOINS AS INTERMEDIATES FOR PHARMACEUTICALLY ACTIVE INGREDIENTS Aventis Pharma Deutschland GmbH (DE) 2004-01-21 EP disclosed
US-6680333-B2 ANTIINFLAMMATORY AGENTS; RHEUMATIC DISEASES; ANTIALLERGENS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-01-20 US disclosed
EP-1373249-A1 IMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION, AND THEIR USE AS ANTINFLAMATORY AGENT Aventis Pharma Deutschland GmbH (DE) 2004-01-02 EP disclosed
EP-1183241-B1 SPIROIMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL PREPARATIONS COMPRISING THEM AVENTIS PHARMA GMBH (DE) 2003-09-17 EP disclosed
US-20030109497-A1 Novel imidazolidine derivatives, their preparation and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2003-06-12 US disclosed
US-20030073723-A1 Novel imidazolidine derivatives, their preparation, their use and pharmaceutical preparations comprising them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2003-04-17 US disclosed
WO-2003011288-A1 NOVEL IMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS VLA-4 ANTAGONISTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-02-13 WO disclosed
US-20020183374-A1 Bis(trifluoromethyl)hydantoins as intermediates for pharmaceutically active ingredients SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2002-12-05 US disclosed
WO-2002072573-A1 IMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION, AND THEIR USE AS ANTINFLAMATORY AGENT. AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-09-19 WO disclosed
WO-2002072557-A1 BIS(TRIFLUOROMETHYL)HYDANTOINS AS INTERMEDIATES FOR PHARMACEUTICALLY ACTIVE INGREDIENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-09-19 WO disclosed
US-6399643-B1 ANTIINFLAMMATORY AGENTS; ANTIARTHRITIC AGENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-06-04 US disclosed
EP-1183241-A1 SPIROIMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL PREPARATIONS COMPRISING THEM Aventis Pharma Deutschland GmbH (DE) 2002-03-06 EP disclosed
WO-2000069831-A1 SPIROIMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL PREPARATIONS COMPRISING THEM AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-11-23 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 (3 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-20030073723-A1 Novel imidazolidine derivatives, their preparation, their use and pharmaceutical preparations comprising them VCAM1, ITGA4, ITGA1 MEN1 4355/4885KMT2A 1766/4885GAA 2950/4885
US-20020183374-A1 Bis(trifluoromethyl)hydantoins as intermediates for pharmaceutically active ingredients HRH1, ALDH7A1, HRH4 MEN1 921/4885KMT2A 1248/4885GAA 1526/4885
US-20030109497-A1 Novel imidazolidine derivatives, their preparation and their use VCAM1, ITGA1, ITGA4 MEN1 4652/4885KMT2A 1692/4885GAA 3526/4885

“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.