SCHEMBL1961925

SCHEMBL1961925

COc1cnc2c(c1)cc(C(O)CC1CCCC1)n2S(=O)(=O)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 2/20 0.36
HTR6 P50406 3/20 0.36
POLB P06746 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RAB9A P51151 1/20 0.35
RECQL P46063 1/20 0.35
IDO1 P14902 1/20 0.35
TDO2 P48775 1/20 0.35
KCNQ1 P51787 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PKM P14618 2/20 0.34
MAPK1 P28482 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
SCHEMBL1961549 0.99 IDO1 (0.36) FKBP1AHTR6POLBL3MBTL1RAB9A
SCHEMBL1959821 0.92 NPC1 (0.36) HTR6POLBL3MBTL1RECQLLMNA
SCHEMBL27889611 0.90 CASP3 (0.34) FKBP1ARECQLIDO1TDO2LMNA
SCHEMBL1962077 0.87 PDE5A (0.38) RECQLIDO1TDO2
SCHEMBL1962889 0.87 AADAT (0.34) FKBP1AHTR6RECQLIDO1TDO2
SCHEMBL1962683 0.87 ALDH1A1 (0.39) MEN1LMNAHTTKMT2ASMN1; SMN2
SCHEMBL1959421 0.86 KDM4E (0.36) LMNAKMT2ASMN1; SMN2
SCHEMBL1963563 0.85 RECQL (0.36) HTR6RECQLIDO1TDO2
SCHEMBL1958810 0.84 SMN1; SMN2 (0.35) HTR6POLBRAB9ARECQLIDO1
SCHEMBL1960371 0.83 PTGDR (0.34) HTR6RECQLIDO1TDO2LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2513103-A1 AZAINDOLE GLUCOKINASE ACTIVATORS F. Hoffmann-La Roche AG (CH) 2012-10-24 EP disclosed
US-8222416-B2 Azaindole glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2012-07-17 US disclosed
WO-2011073117-A1 AZAINDOLE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2011-06-23 WO disclosed
US-20110144105-A1 AZAINDOLE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2011-06-16 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-20110144105-A1 AZAINDOLE GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 FKBP1A 3485/4885HTR6 1441/4885POLB 3362/4885

“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.