SCHEMBL2176168

SCHEMBL2176168

COCCCOc1cc(/C=C/c2c(F)cccc2F)cc(C(=O)O)c1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCK P35557 9/20 0.57
PLA2G2A P14555 1/20 0.41
FFAR1 O14842 1/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41
KMT2A Q03164 1/20 0.40
KAT6A Q92794 3/20 0.40
NFE2L2 Q16236 1/20 0.38
KRAS P01116 1/20 0.38
NR1H4 Q96RI1 1/20 0.38

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
SCHEMBL2178362 0.86 GCK (0.79) GCK
SCHEMBL2176171 0.82 GCK (0.73) GCK
SCHEMBL2175944 0.81 GCK (0.52) GCKKMT2A
SCHEMBL2180450 0.81 GCK (0.58) GCK
SCHEMBL2178128 0.80 GCK (0.77) GCK
SCHEMBL2177451 0.79 GCK (0.57) GCKPLA2G2AFFAR1PPARGPPARD
SCHEMBL2176418 0.76 GCK (0.69) GCK
SCHEMBL2177511 0.76 GCK (0.56) GCKPLA2G2AKMT2ANR1H4
SCHEMBL3487150 0.75 PLA2G2A (0.67) PLA2G2AKMT2ANR1H4
SCHEMBL2180742 0.75 GCK (0.79) 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 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 1/4885PLA2G2A 4121/4885FFAR1 901/4885

“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.