SCHEMBL2178397

SCHEMBL2178397

COCCCOc1cc(CCc2ccccc2OC)cc(C(=O)Nc2cnccn2)c1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GCK P35557 6/20 0.55
NR3C2 P08235 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CHRNB2 P17787 1/20 0.47
CHRNB4 P30926 1/20 0.47
CHRNA3 P32297 1/20 0.47
CHRNA4 P43681 1/20 0.47
ABCB1 P08183 2/20 0.47
KDM4E B2RXH2 1/20 0.45
TSHR P16473 1/20 0.45
POLB P06746 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.43
HTR1A P08908 1/20 0.42
DRD2 P14416 1/20 0.42
GAA P10253 1/20 0.41
NOTUM Q6P988 1/20 0.40

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
SCHEMBL2177674 0.91 CHRNB2 (0.49) GCKMEN1KMT2ACHRNB2CHRNB4
SCHEMBL2181200 0.89 GCK (0.55) GCKNR3C2CHRNB2CHRNB4CHRNA3
SCHEMBL2178406 0.88 GCK (0.71) GCKNR3C2
SCHEMBL2179947 0.85 GCK (0.52) GCKKMT2ACHRNB2CHRNB4CHRNA3
SCHEMBL2177151 0.83 GCK (0.77) GCK
SCHEMBL2178906 0.83 CHRNB2 (0.53) GCKMEN1KMT2ACHRNB2CHRNB4
SCHEMBL2176615 0.82 SMN1; SMN2 (0.51) GCKNR3C2MEN1KMT2APOLB
SCHEMBL2175813 0.82 CHRNB2 (0.54) GCKKMT2ACHRNB2CHRNB4CHRNA3
SCHEMBL2175884 0.80 GCK (0.59) GCKMEN1KMT2ACHRNB2CHRNB4
SCHEMBL2177678 0.79 GCK (0.60) GCK

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 1/4885NR3C2 4046/4885MEN1 4297/4885

“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.