SCHEMBL30100501

SCHEMBL30100501

CC(C)(C)OC(=O)N1CCC(Nc2ccc(NC(=O)c3cc(Cl)ccc3O)c(Cl)c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
MAPT P10636 4/20 0.52
MAPK1 P28482 3/20 0.52
NPC1 O15118 2/20 0.52
HTT P42858 2/20 0.52
RAB9A P51151 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
TP53 P04637 3/20 0.46
CNR1 P21554 4/20 0.46
GPR35 Q9HC97 2/20 0.46
GPR55 Q9Y2T6 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
NR3C1 P04150 2/20 0.46
CNR2 P34972 1/20 0.45
AURKA O14965 1/20 0.44
PDPK1 O15530 1/20 0.44
JAK2 O60674 1/20 0.44
GMNN O75496 1/20 0.44

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
SCHEMBL23675383 1.00 ALDH1A1 (0.52) ALDH1A1MAPTMAPK1NPC1HTT
SCHEMBL30100466 0.87 PKM (0.45) ALDH1A1MAPTMAPK1NPC1HTT
SCHEMBL23675400 0.87 PKM (0.45) ALDH1A1MAPTMAPK1NPC1HTT
SCHEMBL26099029 0.86 MEN1 (0.49) ALDH1A1MAPTMAPK1NPC1HTT
SCHEMBL30100442 0.84 CNR1 (0.54) ALDH1A1MAPTMAPK1NPC1HTT
SCHEMBL23675378 0.84 CNR1 (0.54) ALDH1A1MAPTMAPK1NPC1HTT
SCHEMBL23675432 0.81 RAB9A (0.55) ALDH1A1MAPTMAPK1NPC1HTT
SCHEMBL26095655 0.81 RAB9A (0.54) ALDH1A1MAPTMAPK1NPC1HTT
SCHEMBL4716931 0.80 ALDH1A1 (0.57) ALDH1A1MAPTMAPK1NPC1HTT
SCHEMBL31282736 0.80 ALDH1A1 (0.57) ALDH1A1MAPTMAPK1NPC1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230140290-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING THE BOARD OF REGENTS OF THE UNIV OF TEXAS SY (US) 2023-05-04 US disclosed
EP-4093401-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING The Board of Regents of the University of Texas System (US) 2022-11-30 EP 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-20230140290-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING EIF2AK2, SARS1, ACE ALDH1A1 770/4885MAPT 3403/4885MAPK1 3777/4885

“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.