SCHEMBL4980641

SCHEMBL4980641

COc1ccccc1CNC(=O)NC1CCN(C)CC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.63
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
SIGMAR1 Q99720 1/20 0.56
HPGD P15428 2/20 0.55
LMNA P02545 1/20 0.55
ALDH1A1 P00352 4/20 0.54
NPC1 O15118 1/20 0.54
CYP3A4 P08684 1/20 0.54
GAA P10253 1/20 0.54
CHEK1 O14757 1/20 0.54
IKBKB O14920 1/20 0.54
AURKA O14965 1/20 0.54
PAK4 O96013 1/20 0.54
CHEK2 O96017 1/20 0.54
ABL1 P00519 1/20 0.54
EGFR P00533 1/20 0.54
INSR P06213 1/20 0.54
LCK P06239 1/20 0.54
FGFR1 P11362 1/20 0.54

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
SCHEMBL4981461 0.90 MCHR1 (0.52) MCHR1SIGMAR1LMNAALDH1A1NPC1
SCHEMBL4981131 0.88 SSTR4 (0.59) MCHR1MEN1KMT2ALMNAALDH1A1
SCHEMBL4982014 0.85 SIGMAR1 (0.56) MCHR1MEN1KMT2ASIGMAR1LMNA
SCHEMBL4981108 0.85 KMT2A (0.58) MCHR1MEN1KMT2ASIGMAR1ALDH1A1
SCHEMBL4982505 0.84 DRD4 (0.51) MCHR1HPGDALDH1A1NPC1SSTR1
SCHEMBL4982989 0.82 NPC1 (0.57) MEN1KMT2ASIGMAR1ALDH1A1NPC1
SCHEMBL4979498 0.80 ALDH1A1 (0.63) MCHR1MEN1KMT2ASIGMAR1HPGD
SCHEMBL4983338 0.80 SIGMAR1 (0.55) SIGMAR1ALDH1A1CYP3A4POLBTSHR
SCHEMBL14428725 0.80 MCHR1 (0.50) MCHR1MEN1KMT2ASIGMAR1HPGD
SCHEMBL4795073 0.79 MCHR1 (0.54) MCHR1MEN1KMT2ASIGMAR1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands ASTRAZENECA AB (SE) 2008-03-13 US disclosed
US-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands ASTRAZENECA AB (SE) 2008-03-13 US disclosed
US-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands ASTRAZENECA AB (SE) 2008-03-13 US 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-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands HRH3, HRH1, HRH4 MCHR1 132/4885MEN1 3498/4885KMT2A 395/4885

“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.