SCHEMBL2176273

SCHEMBL2176273

COC[C@H](C)Oc1cc(CCc2cccc(OC)c2OC)cc(C(=O)Nc2nccs2)c1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCK P35557 17/20 0.58
KCNH2 Q12809 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.50
BRD4 O60885 1/20 0.50
MAPT P10636 1/20 0.50
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL2176618 0.93 GCK (0.67) GCKKCNH2SMN1; SMN2BRD4MAPT
SCHEMBL2176271 0.89 SMN1; SMN2 (0.53) GCKSMN1; SMN2BRD4MAPTRAB9A
SCHEMBL2178983 0.86 GCK (0.67) GCKKCNH2
SCHEMBL2180025 0.86 GCK (0.60) GCKKCNH2
Hydrochloric Acid SCHEMBL2178395 0.85 GCK (0.59) GCKKCNH2
SCHEMBL2178412 0.85 GCK (0.66) GCKKCNH2
SCHEMBL2177040 0.85 GCK (0.58) GCKKCNH2
SCHEMBL2177705 0.84 GCK (0.67) GCKKCNH2
SCHEMBL2176768 0.84 GCK (0.61) GCKKCNH2SMN1; SMN2RAB9ANPC1
SCHEMBL2178810 0.84 GCK (0.68) GCKKCNH2SMN1; SMN2RAB9ANPC1

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
US-20120178765-A1 NOVEL GLUCOKINASE ACTIVATORS AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2012-07-12 US claimed
WO-2011081280-A2 NOVEL GLUCOKINASE ACTIVATORS AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2011-07-07 WO claimed
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.