SCHEMBL840728

SCHEMBL840728

CC1CCCN(Cc2cccc(Br)n2)C1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.53
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
FAAH O00519 1/20 0.43
HRH3 Q9Y5N1 4/20 0.42
KMT2A Q03164 3/20 0.42
HPGD P15428 2/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
PDE2A O00408 1/20 0.42
TAAR1 Q96RJ0 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ACHE P22303 1/20 0.41

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
SCHEMBL19493580 0.84 MAPT (0.56) LMNAALDH1A1KDM4ECYP3A4CYP2C19
SCHEMBL17086662 0.84 MAPT (0.56) LMNAALDH1A1KDM4ECYP3A4CYP2C19
SCHEMBL5337678 0.83 LMNA (0.60) LMNAALDH1A1KDM4ECYP3A4CYP2C19
SCHEMBL18933308 0.83 LMNA (0.53) LMNAALDH1A1KDM4ECYP3A4CYP2C19
SCHEMBL5345901 0.83 ALDH1A1 (0.55) LMNAALDH1A1KDM4EFAAHKMT2A
SCHEMBL838790 0.83 FAAH (0.43) LMNAALDH1A1KDM4EFAAHHRH3
SCHEMBL5345126 0.82 HRH3 (0.46) ALDH1A1KDM4ECYP3A4FAAHHRH3
SCHEMBL5345098 0.82 ACHE (0.50) LMNAALDH1A1FAAHHRH3ACHE
SCHEMBL840253 0.80 KMT2A (0.46) LMNAFAAHKMT2AMAPTMEN1
SCHEMBL839038 0.79 FAAH (0.53) ALDH1A1KDM4ECYP2C19FAAHHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143246-B2 1-(4-(pyridin-2-yl)benzyl)imidazolidine-2,4-dione derivatives MSD OSS B.V. (NL) 2012-03-27 US disclosed
EP-2373639-A1 1-(4-(PYRIDIN-2-YL)BENZYL)IMIDAZOLIDINE-2,4-DIONE DERIVATIVES N.V. Organon (NL) 2011-10-12 EP disclosed
US-20100144724-A1 1-(4-(PYRIDIN-2-YL)BENZYL)IMIDAZOLIDINE-2,4-DIONE DERIVATIVES N.V.ORGANON 2010-06-10 US disclosed
WO-2010063666-A1 1-(4-(PYRIDIN-2-YL)BENZYL)IMIDAZOLIDINE-2,4-DIONE DERIVATIVES N.V. ORGANON (NL) 2010-06-10 WO disclosed
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US disclosed
EP-1309589-B1 UREA COMPOUNDS AND METHODS OF USES AMGEN INC (US) 2006-03-15 EP disclosed
EP-1619184-A2 Urea compounds as kinase inhibitors Amgen, Inc. (US) 2006-01-25 EP disclosed
EP-1483263-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER Amgen Inc. (US) 2004-12-08 EP disclosed
US-20040044044-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-03-04 US disclosed
US-20040039029-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-02-26 US disclosed
US-6645990-B2 For prophylaxis and therapy of diseases, such as cell proliferation or apoptosis mediated diseases AMGEN INC. 2003-11-11 US disclosed
WO-2003070727-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER AMGEN INC. (US) 2003-08-28 WO disclosed
EP-1309589-A2 UREA COMPOUNDS AND METHODS OF USES Amgen Inc. (US) 2003-05-14 EP disclosed
US-20020193405-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2002-12-19 US disclosed
US-20020173507-A1 Urea compounds and methods of uses AMGEN INC. 2002-11-21 US disclosed
WO-2002014311-A2 UREA COMPOUNDS AND METHODS OF USES AMGEN INC. (US) 2002-02-21 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 (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-20020193405-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX LMNA 2067/4885ALDH1A1 810/4885KDM4E 2714/4885
US-20020173507-A1 Urea compounds and methods of uses SLC14A1, UMPS, BAX LMNA 1241/4885ALDH1A1 865/4885KDM4E 1709/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX LMNA 2067/4885ALDH1A1 810/4885KDM4E 2714/4885
US-20100144724-A1 1-(4-(PYRIDIN-2-YL)BENZYL)IMIDAZOLIDINE-2,4-DIONE DERIVATIVES OPRD1, CNR1, CNR2 LMNA 4725/4885ALDH1A1 3782/4885KDM4E 2573/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX LMNA 2067/4885ALDH1A1 810/4885KDM4E 2714/4885

“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.