SCHEMBL25925124

SCHEMBL25925124

CCOC(=O)Cn1ncc(C)c1N

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.64
MAPK1 P28482 2/20 0.47
XDH P47989 1/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TSHR P16473 3/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.44
NPC1 O15118 1/20 0.44
PTGS2 P35354 1/20 0.44
GSK3A P49840 1/20 0.44
GSK3B P49841 1/20 0.44
CYP2C19 P33261 1/20 0.43
HTT P42858 1/20 0.42
POLB P06746 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HSD17B10 Q99714 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
SCHEMBL19208198 0.81 SMN1; SMN2 (0.57) SMN1; SMN2XDHMEN1KMT2ATSHR
SCHEMBL5148552 0.81 SMN1; SMN2 (0.57) SMN1; SMN2MAPK1XDHKMT2AALDH1A1
SCHEMBL2888331 0.75 SMN1; SMN2 (0.51) SMN1; SMN2MAPK1XDHMEN1KMT2A
SCHEMBL14663783 0.74 SMN1; SMN2 (0.47) SMN1; SMN2MAPK1XDHTSHRALDH1A1
SCHEMBL15656246 0.74 ALDH1A1 (0.61) SMN1; SMN2MAPK1MEN1KMT2ATSHR
SCHEMBL20553301 0.74 SMN1; SMN2 (0.50) SMN1; SMN2MAPK1XDHMEN1KMT2A
SCHEMBL13024307 0.74 SMN1; SMN2 (0.50) SMN1; SMN2MAPK1XDHMEN1KMT2A
SCHEMBL24920108 0.74 NPC1 (0.56) SMN1; SMN2MEN1KMT2ATSHRALDH1A1
Hydrochloric Acid SCHEMBL21847655 0.73 ALDH1A1 (0.60) SMN1; SMN2MAPK1MEN1KMT2ATSHR
Hydrochloric Acid SCHEMBL28862024 0.73 SMN1; SMN2 (0.46) SMN1; SMN2MAPK1XDHTSHRALDH1A1

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 SMN1; SMN2 2279/4885MAPK1 1424/4885XDH 59/4885

“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.