SCHEMBL3550333

SCHEMBL3550333

COCCN(C)Cc1nc(C(=O)O)cs1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 10/20 0.50
MMP2 P08253 8/20 0.50
MMP1 P03956 6/20 0.50
MMP9 P14780 6/20 0.50
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 3/20 0.36
PTGER1 P34995 1/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
RAB9A P51151 1/20 0.36
NPC1 O15118 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL2077382 0.84 NPC1 (0.52) MMP13MMP1ALDH1A1LMNAMAPT
SCHEMBL1807247 0.79 MMP13 (0.60) MMP13MMP2MMP1MMP9L3MBTL1
SCHEMBL3544712 0.78 RAB9A (0.35) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL29677688 0.77 MMP13 (0.59) MMP13MMP2MMP1MMP9L3MBTL1
SCHEMBL3551333 0.77 ALDH1A1 (0.41) MMP13MMP2MMP1MMP9L3MBTL1
SCHEMBL3545624 0.77 MMP1 (0.44) MMP13MMP2MMP1MMP9L3MBTL1
Hydrochloric Acid SCHEMBL2077470 0.76 ALDH1A1 (0.40) MMP13MMP2MMP1MMP9L3MBTL1
SCHEMBL1421532 0.76 MMP2 (0.49) MMP13MMP2MMP1MMP9L3MBTL1
SCHEMBL1431231 0.71 MMP13 (0.59) MMP13MMP2MMP1MMP9L3MBTL1
SCHEMBL16057689 0.71 MMP13 (0.49) MMP13MMP2MMP1MMP9L3MBTL1

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 3 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
EP-2009005-A1 AZOLECARBOXAMIDE DERIVATIVE Astellas Pharma Inc. (JP) 2008-12-31 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-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE GPR17, NTRK1, TRPV1 MMP13 4297/4885MMP2 4446/4885MMP1 1223/4885

“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.