SCHEMBL965948

SCHEMBL965948

Cc1nn(C)c(-n2ccc3cc(Cl)ccc32)c1CCN(C(=O)O)S(=O)(=O)NCCOC(C)C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
PLA2G4A P47712 7/20 0.34
PHGDH O43175 9/20 0.34
USP2 O75604 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TP53 P04637 1/20 0.32

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
SCHEMBL966800 0.96 USP2 (0.36) LMNAPLA2G4APHGDHUSP2KMT2A
SCHEMBL966982 0.92 PHGDH (0.34) LMNAPLA2G4APHGDHUSP2KMT2A
SCHEMBL964534 0.80 ALDH1A1 (0.37) LMNAKMT2AALDH1A1TP53
SCHEMBL964022 0.80 USP2 (0.35) USP2KMT2A
SCHEMBL962091 0.79 PHGDH (0.34) LMNAPLA2G4APHGDHKMT2A
SCHEMBL966098 0.79 OXER1 (0.34) LMNA
SCHEMBL967867 0.79 PHGDH (0.35) LMNAPLA2G4APHGDHKMT2A
SCHEMBL966868 0.78 SLC6A2 (0.35) LMNAPLA2G4APHGDHHTTSMN1; SMN2
SCHEMBL967888 0.77 MAPK8 (0.34) LMNAPLA2G4APHGDHKMT2AHTT
SCHEMBL962764 0.77 USP2 (0.33) USP2KMT2A

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 LMNA 3461/4885PLA2G4A 1094/4885PHGDH 1142/4885

“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.