SCHEMBL758126

SCHEMBL758126

CC(C)NS(=O)(=O)c1ccc(N)cn1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA4 P22748 1/20 0.55
CA6 P23280 1/20 0.55
CA5A P35218 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA13 Q8N1Q1 1/20 0.55
CA14 Q9ULX7 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
BRD4 O60885 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34

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
SCHEMBL7912693 0.81 SLC40A1 (0.47) CA12CA1CA2CA4CA6
SCHEMBL25825555 0.79 EDNRA (0.42) ALDH1A1LMNASMN1; SMN2KDM4EGAA
SCHEMBL21885975 0.79 CHRM2 (0.43) L3MBTL1ALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL2642532 0.77 CA12 (0.60) CA12CA1CA2CA4CA6
SCHEMBL1492547 0.74 CA12 (0.67) CA12CA1CA2CA4CA6
SCHEMBL31279787 0.74 CA12 (0.67) CA12CA1CA2CA4CA6
SCHEMBL758127 0.73 CA12 (0.58) CA12CA1CA2CA4CA6
SCHEMBL5453607 0.72 ALDH1A1 (0.58) CA12CA1CA2CA9L3MBTL1
SCHEMBL578901 0.71 L3MBTL1 (0.51) L3MBTL1KMT2AMMP2KDM4ETSHR
SCHEMBL4063653 0.71 CA2 (1.00) CA12CA1CA2CA4CA6

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-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 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 (2 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-20070282101-A1 Indazole compounds CYP3A43, CYP3A7, UGT1A1 CA12 3232/4885CA1 3728/4885CA2 3954/4885
US-20120053345-A1 Indazole Compounds CYP3A43, CYP3A7, UGT1A1 CA12 3232/4885CA1 3728/4885CA2 3954/4885

“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.