SCHEMBL14784686

SCHEMBL14784686

CC(C)N(C(=O)c1nccc(Cl)c1CCCCl)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
PKM P14618 2/20 0.36
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34
TSHR P16473 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MCOLN3 Q8TDD5 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
RIPK1 Q13546 1/20 0.30

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
SCHEMBL714506 0.85 ALDH1A1 (0.36) MEN1KMT2APKMKDM4EGAA
SCHEMBL10517816 0.72 RIPK1 (0.42) MEN1KMT2APKMKDM4EGAA
SCHEMBL16196315 0.71 CCNB2 (0.33) GAA
SCHEMBL18438840 0.68 L3MBTL1 (0.36) POLBMAPTL3MBTL1
SCHEMBL29009767 0.64 FFAR1 (0.41) TSHRALDH1A1MAPT
SCHEMBL20897984 0.64 LMNA (0.42) MEN1KMT2AKDM4EGAAALDH1A1
SCHEMBL8828511 0.63 ROCK2 (0.47) PKMTSHRPOLB
SCHEMBL712142 0.63 ALDH1A1 (0.62) MEN1KMT2APKMKDM4EHPGD
SCHEMBL30726837 0.63 ALDH1A1 (0.62) MEN1KMT2APKMKDM4EHPGD
SCHEMBL30726838 0.63 ALDH1A1 (0.62) MEN1KMT2APKMKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2766344-B1 EP1 RECEPTOR LIGANDS ESTEVE LABOR DR (ES) 2017-05-03 EP disclosed
US-9518015-B2 EP1 receptor ligands LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2016-12-13 US disclosed
US-20140323475-A1 EP1 RECEPTOR LIGANDS ESTEVE PHARMACEUTICALS, S.A. (ES) 2014-10-30 US disclosed
EP-2766344-A1 EP1 RECEPTOR LIGANDS Laboratorios Del. Dr. Esteve, S.A. (ES) 2014-08-20 EP disclosed
WO-2013037960-A1 EP1 RECEPTOR LIGANDS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2013-03-21 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 (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-20140323475-A1 EP1 RECEPTOR LIGANDS PTGER1, PTGER2, PTGIR MEN1 2975/4885KMT2A 4002/4885PKM 2252/4885

“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.