SCHEMBL3549078

SCHEMBL3549078

CC1OC(c2csc(N3CCC(CO)CC3)n2)O1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 9/20 0.36
RAB9A P51151 6/20 0.36
NPC1 O15118 5/20 0.36
LMNA P02545 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
AR P10275 1/20 0.33
PDE10A Q9Y233 1/20 0.33
HIF1A Q16665 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL13162283 0.85 LMNA (0.37) SMN1; SMN2RAB9ANPC1LMNAAR
SCHEMBL13270611 0.82 AR (0.44) SMN1; SMN2RAB9ANPC1LMNAAR
SCHEMBL13162279 0.81 AR (0.47) SMN1; SMN2RAB9ANPC1LMNAAR
SCHEMBL13162281 0.81 MAPT (0.37) SMN1; SMN2RAB9ANPC1LMNAHRH3
SCHEMBL13638865 0.80 LMNA (0.52) SMN1; SMN2RAB9ANPC1LMNAAR
SCHEMBL13161927 0.79 NPC1 (0.36) SMN1; SMN2RAB9ANPC1LMNAHRH3
SCHEMBL458365 0.76 HRH3 (0.48) SMN1; SMN2RAB9ANPC1LMNAHRH3
SCHEMBL13162277 0.76 AR (0.34) SMN1; SMN2RAB9ANPC1LMNAHRH3
SCHEMBL13161907 0.76 RAB9A (0.37) SMN1; SMN2RAB9ANPC1HRH3AR
SCHEMBL13162773 0.76 MTOR (0.34)

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-8163746-B2 Azolecarboxamide derivative ASTELLAS PHARMA INC. (JP) 2012-04-24 US disclosed
US-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-11-19 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-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE GPR17, NTRK1, TRPV1 SMN1; SMN2 3601/4885RAB9A 4401/4885NPC1 4245/4885

“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.