SCHEMBL2177748

SCHEMBL2177748

COC[C@H](C)Oc1cc(CO)cc(C(=O)Nc2nccs2)c1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GCK P35557 17/20 0.71
KCNH2 Q12809 2/20 0.66
SMN1; SMN2 Q16637 2/20 0.49
BRD4 O60885 1/20 0.49
MAPT P10636 1/20 0.49
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL2176268 0.91 GCK (0.70) GCKKCNH2SMN1; SMN2BRD4MAPT
SCHEMBL2664578 0.88 GCK (0.61) GCKKCNH2SMN1; SMN2BRD4MAPT
SCHEMBL13891667 0.88 GCK (0.74) GCKKCNH2SMN1; SMN2BRD4MAPT
SCHEMBL1146562 0.88 GCK (0.74) GCKKCNH2SMN1; SMN2BRD4MAPT
SCHEMBL2179788 0.86 GCK (0.64) GCKKCNH2SMN1; SMN2NPC1RAB9A
SCHEMBL2177746 0.85 GCK (0.54) GCKKCNH2SMN1; SMN2BRD4MAPT
SCHEMBL2176835 0.85 GCK (0.55) GCKKCNH2SMN1; SMN2BRD4MAPT
Hydrochloric Acid SCHEMBL2178615 0.85 GCK (0.63) GCKKCNH2SMN1; SMN2NPC1RAB9A
SCHEMBL2176233 0.84 GCK (0.62) GCKKCNH2
SCHEMBL2176768 0.84 GCK (0.61) GCKKCNH2SMN1; SMN2NPC1RAB9A

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-20120178765-A1 NOVEL GLUCOKINASE ACTIVATORS AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2012-07-12 US disclosed
WO-2011081280-A2 NOVEL GLUCOKINASE ACTIVATORS AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2011-07-07 WO 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-20120178765-A1 NOVEL GLUCOKINASE ACTIVATORS AND PROCESSES FOR THE PREPARATION THEREOF GCK, GCKR, HK1 GCK 1/4885KCNH2 1465/4885SMN1; SMN2 4303/4885

“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.