SCHEMBL966982

SCHEMBL966982

Cc1nn(C)c(-n2ccc3cc(Cl)ccc32)c1CN(C(=O)O)S(=O)(=O)NCCOC(C)C

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 12/20 0.34
KMT2A Q03164 2/20 0.34
USP2 O75604 1/20 0.34
PLA2G4A P47712 3/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MEN1 O00255 1/20 0.31
NPY5R Q15761 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL965948 0.92 LMNA (0.34) PHGDHKMT2AUSP2PLA2G4AALDH1A1
SCHEMBL966800 0.92 USP2 (0.36) PHGDHKMT2AUSP2PLA2G4AALDH1A1
SCHEMBL963605 0.80 TRPM8 (0.41) PHGDHKMT2AALDH1A1LMNAHTT
SCHEMBL963820 0.80 TRPM8 (0.38) PHGDHLMNAHTTSMN1; SMN2
SCHEMBL963628 0.78 TAS2R14 (0.40) KMT2AALDH1A1LMNASMN1; SMN2POLB
SCHEMBL966630 0.78 PTGDR2 (0.34) PHGDH
SCHEMBL4554170 0.78 PHGDH (0.34) PHGDHKMT2AMEN1NPY5R
SCHEMBL968497 0.77 MAPT (0.35) PHGDHKMT2AUSP2PLA2G4ALMNA
SCHEMBL968493 0.77 MAPT (0.35) PHGDHKMT2AUSP2PLA2G4ALMNA
SCHEMBL967867 0.77 PHGDH (0.35) PHGDHKMT2APLA2G4ALMNAMEN1

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-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-13 US disclosed
US-20080194617-A1 Fused ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-14 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-20080194617-A1 Fused ring compound SLC5A1, SLC5A2, GPR119 PHGDH 1137/4885KMT2A 1809/4885USP2 4346/4885
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA PPARA, PPARD, PPARG PHGDH 1142/4885KMT2A 2017/4885USP2 4289/4885

“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.