SCHEMBL963548

SCHEMBL963548

CCCNS(=O)(=O)N(Cc1ccccc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.47
CA9 Q16790 2/20 0.47
HSD11B1 P28845 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MAPT P10636 1/20 0.43
LMNA P02545 1/20 0.42
TAS2R14 Q9NYV8 2/20 0.42
PTGES O14684 1/20 0.41
LIMK1 P53667 1/20 0.40
CNR2 P34972 1/20 0.40

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
SCHEMBL966590 0.91 CA12 (0.49) CA12CA9HSD11B1MEN1KMT2A
SCHEMBL966298 0.90 CA12 (0.50) CA12CA9HSD11B1MEN1KMT2A
SCHEMBL963555 0.87 HSD11B1 (0.46) CA12CA9HSD11B1MEN1KMT2A
SCHEMBL962182 0.84 L3MBTL1 (0.48) HSD11B1MEN1KMT2ANPC1RAB9A
SCHEMBL964483 0.80 MEN1 (0.44) HSD11B1MEN1KMT2ANPC1RAB9A
SCHEMBL963199 0.78 GAA (0.46) MEN1KMT2ARAB9AMAPTLMNA
SCHEMBL963233 0.78 MEN1 (0.44) HSD11B1MEN1KMT2ANPC1RAB9A
SCHEMBL963552 0.77 MEN1 (0.46) HSD11B1MEN1KMT2ANPC1RAB9A
SCHEMBL4602434 0.76 LMNA (0.50) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL964699 0.76 GBA1 (0.50) HSD11B1MEN1KMT2AMAPTPTGES

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-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-13 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-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA PPARA, PPARD, PPARG CA12 4707/4885CA9 3464/4885HSD11B1 315/4885

“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.