SCHEMBL14357643

SCHEMBL14357643

COCCc1cc(NC(=O)CCC(=O)Nc2ccc(OCOC)c(OCOC)c2)ccc1OCOC

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
MAPT P10636 4/20 0.44
HSD17B10 Q99714 1/20 0.44
HDAC1 Q13547 4/20 0.42
HDAC2 Q92769 4/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
CTSL P07711 1/20 0.40
PTPRC P08575 1/20 0.40
PTPN13 Q12923 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
BRD4 O60885 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL14357640 0.90 MAPT (0.46) NPC1RAB9AMAPTHSD17B10MEN1
SCHEMBL2605629 0.89 NPSR1 (0.49) NPC1RAB9AMAPTHSD17B10NPSR1
SCHEMBL2605641 0.78 MAPT (0.51) NPC1RAB9AMAPTHSD17B10ALDH1A1
SCHEMBL8420347 0.72 MAPT (0.59) NPC1RAB9AMAPTHSD17B10HDAC1
SCHEMBL5414824 0.71 CYP1A2 (0.57) NPC1RAB9AMAPTNPSR1MEN1
SCHEMBL29135179 0.71 KMT2A (0.52) RAB9AMAPTHSD17B10MEN1KMT2A
SCHEMBL2601947 0.71 NPC1 (0.56) NPC1RAB9AMAPTMEN1ALDH1A1
SCHEMBL2601945 0.71 TOP1 (0.57) NPC1RAB9AMAPTMEN1ALDH1A1
SCHEMBL7333738 0.68 LMNA (0.54) NPC1RAB9AMAPTHSD17B10ALDH1A1
SCHEMBL8003660 0.68 NPSR1 (0.50) NPC1RAB9AMAPTHDAC1HDAC2

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-20070276034-A1 Compounds, compositions and methods for the treatment of synucleinopathies PROTEOTECH, INC. 2007-11-29 US disclosed
US-20070276034-A1 Compounds, compositions and methods for the treatment of synucleinopathies PROTEOTECH, INC. 2007-11-29 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 (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-20070276034-A1 Compounds, compositions and methods for the treatment of synucleinopathies SNCA, PARK7, COMT NPC1 107/4885RAB9A 326/4885MAPT 6/4885

“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.