SCHEMBL1958741

SCHEMBL1958741

O=S(=O)(c1ccccc1)n1c(C(O)CC2CCOCC2)cc2cc(F)cnc21

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.35
HTT P42858 1/20 0.34
CYP11B2 P19099 1/20 0.34
GCK P35557 9/20 0.34
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33
PDE5A O76074 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
MAPK1 P28482 1/20 0.32
BRD4 O60885 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
SCHEMBL1963563 0.91 RECQL (0.36) RECQLCYP11B2PDE5APDE4APDE4B
SCHEMBL1959821 0.86 NPC1 (0.36) RECQLGCKLMNASMN1; SMN2POLB
SCHEMBL1963113 0.85 RECQL (0.43) RECQLHTTGCKLMNASMN1; SMN2
SCHEMBL2051447 0.84 HTT (0.33) RECQLHTTGCKLMNASMN1; SMN2
SCHEMBL1959015 0.81 RIPK1 (0.38) HTTLMNASMN1; SMN2NPSR1POLB
SCHEMBL1962022 0.80 RORC (0.42)
SCHEMBL27873115 0.80 GCK (0.34) RECQLGCKLMNASMN1; SMN2PDE5A
SCHEMBL1962077 0.80 PDE5A (0.38) RECQLGCKPDE5APDE4APDE4B
SCHEMBL1962048 0.79 ALDH1A1 (0.39) RECQLHTTGCKLMNANPSR1
SCHEMBL1963085 0.79 RECQL (0.39) RECQLLMNA

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 RECQL 3296/4885HTT 2485/4885CYP11B2 1061/4885

“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.