SCHEMBL4597380

SCHEMBL4597380

CC(C)CC(C(=O)O)N1C(=O)NC(C(F)(F)F)(C(F)(F)F)C1=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40
MCL1 Q07820 6/20 0.39
ALDH1A1 P00352 1/20 0.36
BCL2 P10415 5/20 0.36
BCL2L2 Q92843 5/20 0.36
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.33
GRN P28799 1/20 0.32
SORT1 Q99523 1/20 0.32
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32
PSENEN Q9NZ42 1/20 0.32

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
SCHEMBL4597413 1.00 SMN1; SMN2 (0.40) SMN1; SMN2MCL1ALDH1A1BCL2BCL2L2
SCHEMBL4597376 1.00 SMN1; SMN2 (0.40) SMN1; SMN2MCL1ALDH1A1BCL2BCL2L2
SCHEMBL14430803 0.83 ALDH1A1 (0.33) ALDH1A1
SCHEMBL4596857 0.79 KMT2A (0.44) SMN1; SMN2MCL1BCL2BCL2L2LMNA
SCHEMBL4596853 0.79 KMT2A (0.44) SMN1; SMN2MCL1BCL2BCL2L2LMNA
SCHEMBL4596864 0.79 KMT2A (0.44) SMN1; SMN2MCL1BCL2BCL2L2LMNA
SCHEMBL4597416 0.78
SCHEMBL4595583 0.78
SCHEMBL4596916 0.77 ALDH1A1 (0.52) SMN1; SMN2MCL1ALDH1A1LMNAGAA
SCHEMBL4597279 0.77 ALDH1A1 (0.52) SMN1; SMN2MCL1ALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506177-B1 PROCESS FOR THE PREPARATION OF THE ENANTIOMERIC FORMS OF 2-SUBSTITUTED 2-(2,5-DIOXOIMIDAZOLIDIN-1-YL)-ACETIC ACID DERIVATIVES SANOFI AVENTIS DEUTSCHLAND (DE) 2008-01-16 EP disclosed
EP-1381595-B1 BIS(TRIFLUOROMETHYL)HYDANTOINS AS INTERMEDIATES FOR PHARMACEUTICALLY ACTIVE INGREDIENTS SANOFI AVENTIS DEUTSCHLAND (DE) 2007-08-08 EP disclosed
US-6908752-B2 Process for the preparation of the enant iomeric forms of 2-substituted 2- (2, 5-dioxoimidazolidin-1yl) -acetic acid derivatives AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-06-21 US disclosed
EP-1373249-B1 IMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION, AND THEIR USE AS ANTIINFLAMATORY AGENT AVENTIS PHARMA GMBH (DE) 2005-04-20 EP disclosed
EP-1506177-A2 PROCESS FOR THE PREPARATION OF THE ENANTIOMERIC FORMS OF 2-SUBSTITUTED 2-(2,5-DIOXOIMIDAZOLIDIN-1-YL)-ACETIC ACID DERIVATIVES Aventis Pharma Deutschland GmbH (DE) 2005-02-16 EP disclosed
US-6794517-B2 AS CHEMICAL INTERMEDIATE TO FORM DRUGS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-09-21 US 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
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
US-20030054507-A1 Process for the preparation of the enant iomeric forms of 2-substituted 2- (2, 5-dioxoimidazolidin-1-yl) -acetic acid derivatives SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2003-03-20 US disclosed
WO-2003008386-A2 PROCESS FOR THE PREPARATION OF THE ENANTIOMERIC FORMS OF 2-SUBSTITUTED 2-(2,5-DIOXOIMIDAZOLIDIN-1-YL)-ACETIC ACID DERIVATIVES AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-01-30 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 SMN1; SMN2 3812/4885MCL1 987/4885ALDH1A1 594/4885
US-20020183374-A1 Bis(trifluoromethyl)hydantoins as intermediates for pharmaceutically active ingredients HRH1, ALDH7A1, HRH4 SMN1; SMN2 3987/4885MCL1 4149/4885ALDH1A1 156/4885

“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.