SCHEMBL2933683

SCHEMBL2933683

CC(C)CN(CC(C)C)C(=O)C(C)(C)c1ccc(N)c(NCCCN2CCCCC2)c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 2/20 0.39
ANPEP P15144 3/20 0.39
SIGMAR1 Q99720 1/20 0.36
BACE1 P56817 3/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTR4 Q13639 1/20 0.36
MC4R P32245 2/20 0.35
TSHR P16473 1/20 0.35
EHMT2 Q96KQ7 1/20 0.35
GNRHR P30968 1/20 0.34

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
SCHEMBL2938027 0.85 HRH3 (0.46) ACP1ALDH1A1MAPTHTT
SCHEMBL3797761 0.82 GNRHR (0.36) SIGMAR1LMNASMN1; SMN2GNRHR
SCHEMBL2933001 0.77 MC4R (0.54) MC4R
SCHEMBL6428663 0.75 SMN1; SMN2 (0.43) ALDH1A1MAPTSMN1; SMN2
SCHEMBL13124134 0.72 MC4R (0.57) MC4R
SCHEMBL2940093 0.71 BACE1 (0.43) SIGMAR1BACE1MC4R
SCHEMBL27961380 0.71 HRH3 (0.45) ACP1BACE1
SCHEMBL2930807 0.71 ACP1 (0.49) ACP1ALDH1A1LMNAMAPTMC4R
SCHEMBL13124129 0.70 MC4R (0.55) MC4R
SCHEMBL17527302 0.70 HRH3 (0.43) ACP1BACE1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120316201-A1 NOVEL BENZIMIDAZOLE AND IMIDAZOPYRIDINE DERIVATIVES AND USE THEREOF AS A MEDICAMENT IPSEN PHARMA S.A.S. (FR) 2012-12-13 US disclosed
US-8227485-B2 Benzimidazole and imidazopyridine derivatives and use thereof as a medicament IPSEN PHARMA S.A.S. (FR) 2012-07-24 US disclosed
EP-1692114-B1 NOVEL BENZIMIDAZOLE AND IMIDAZOPYRIDINE DERIVATIVES AND USE THEREOF AS A MEDICAMENT IPSEN PHARMA (FR) 2010-09-22 EP disclosed
US-20060281784-A1 Novel benzimidazole and imidazopyridine derivatives and use thereof as a medicament SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (FR) 2006-12-14 US disclosed
EP-1692114-A1 NOVEL BENZIMIDAZOLE AND IMIDAZOPYRIDINE DERIVATIVES AND USE THEREOF AS A MEDICAMENT Société de Conseils de Recherches et d'Applications Scientifiques ( S.C.R.A.S.) (FR) 2006-08-23 EP disclosed
WO-2005056533-A1 NOVEL BENZIMIDAZOLE AND IMIDAZOPYRIDINE DERIVATIVES AND USE THEREOF AS A MEDICAMENT SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2005-06-23 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 (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-20120316201-A1 NOVEL BENZIMIDAZOLE AND IMIDAZOPYRIDINE DERIVATIVES AND USE THEREOF AS A MEDICAMENT MC4R, MC5R, MC1R ACP1 4229/4885ANPEP 2973/4885SIGMAR1 450/4885
US-20060281784-A1 Novel benzimidazole and imidazopyridine derivatives and use thereof as a medicament MC4R, MC5R, MC1R ACP1 4104/4885ANPEP 2930/4885SIGMAR1 438/4885

“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.