SCHEMBL14052467

SCHEMBL14052467

CCN(CC)C(=O)c1ccoc1-c1ccc(C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
HPGD P15428 5/20 0.41
ALDH1A1 P00352 5/20 0.41
MAPT P10636 3/20 0.41
TDP1 Q9NUW8 1/20 0.40
NPSR1 Q6W5P4 2/20 0.38
GAA P10253 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
TP53 P04637 2/20 0.38
MAPK1 P28482 3/20 0.37
GFER P55789 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
LMNA P02545 2/20 0.37
HSP90AA1 P07900 2/20 0.36
HSP90AB1 P08238 2/20 0.36
TSHR P16473 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL14052544 0.87 SMN1; SMN2 (0.50) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL14052375 0.87 RECQL (0.44) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL14052487 0.86 HPGD (0.53) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL14052531 0.85 MAPT (0.39) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL14052453 0.85 ALDH1A1 (0.39) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL14052326 0.84 HPGD (0.51) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL14052466 0.83 TRPV1 (0.42) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL14134406 0.81 MEN1 (0.38) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL14052790 0.79 MEN1 (0.37) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL14052389 0.79 HSP90AA1 (0.38) MEN1KMT2AHPGDALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150166500-A1 Compounds and Methods for Catalytic Directed ortho Substitution of Aromatic Amides and Esters QUEEN'S UNIVERSITY AT KINGSTON (CA) 2015-06-18 US disclosed
US-20150166500-A1 Compounds and Methods for Catalytic Directed ortho Substitution of Aromatic Amides and Esters QUEEN'S UNIVERSITY AT KINGSTON (CA) 2015-06-18 US disclosed
US-20120302752-A1 Compounds and Methods for Catalytic Directed ortho Substitution of Aromatic Amides and Esters QUEEN'S UNIVERSITY AT KINGSTON (CA) 2012-11-29 US disclosed
US-20120302752-A1 Compounds and Methods for Catalytic Directed ortho Substitution of Aromatic Amides and Esters QUEEN'S UNIVERSITY AT KINGSTON (CA) 2012-11-29 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 (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-20150166500-A1 Compounds and Methods for Catalytic Directed ortho Substitution of Aromatic Amides and Esters DDC, AOC2, AOC3 MEN1 4327/4885KMT2A 1382/4885HPGD 2168/4885
US-20120302752-A1 Compounds and Methods for Catalytic Directed ortho Substitution of Aromatic Amides and Esters DDC, AOC2, AOC3 MEN1 4327/4885KMT2A 1382/4885HPGD 2168/4885

“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.