SCHEMBL25933933

SCHEMBL25933933

CCOC(=O)c1cnn(CC(O)OC(C)(C)C)c1N

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.55
LMNA P02545 2/20 0.55
ALDH1A1 P00352 5/20 0.51
HPGD P15428 3/20 0.49
KMT2A Q03164 2/20 0.49
RAB9A P51151 4/20 0.49
KDM4E B2RXH2 2/20 0.49
TSHR P16473 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 1/20 0.47
TP53 P04637 1/20 0.45
MAPT P10636 3/20 0.44
HTT P42858 1/20 0.44
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL4248164 0.83 NPC1 (0.61) NPC1LMNAALDH1A1HPGDKMT2A
SCHEMBL4072652 0.82 NPC1 (0.60) NPC1LMNAALDH1A1HPGDKMT2A
SCHEMBL31352277 0.82 NPC1 (0.62) NPC1LMNAALDH1A1HPGDKMT2A
SCHEMBL9227838 0.81 NPC1 (0.58) NPC1LMNAALDH1A1HPGDKMT2A
SCHEMBL4064412 0.80 NPC1 (0.57) NPC1LMNAALDH1A1HPGDKMT2A
SCHEMBL1137591 0.80 NPC1 (0.60) NPC1LMNAALDH1A1HPGDKMT2A
SCHEMBL31352167 0.79 NPC1 (0.62) NPC1LMNAALDH1A1HPGDKMT2A
SCHEMBL173434 0.79 NPC1 (0.68) NPC1LMNAALDH1A1HPGDKMT2A
SCHEMBL19208815 0.78 NPC1 (0.57) NPC1LMNAALDH1A1HPGDKMT2A
SCHEMBL4070954 0.77 HPGD (0.60) NPC1LMNAALDH1A1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230218578-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-07-13 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-20230218578-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF C9, C5, C1QBP NPC1 315/4885LMNA 1451/4885ALDH1A1 1023/4885

“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.