SCHEMBL2657725

SCHEMBL2657725

N#Cc1cc(-c2ncccc2Cl)ccc1N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 3/20 0.45
HDAC1 Q13547 1/20 0.40
SCN9A Q15858 1/20 0.39
CYP11B1 P15538 1/20 0.39
CNR2 P34972 3/20 0.38
PLAUR Q03405 1/20 0.38
ALDH1A1 P00352 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ADORA2A P29274 3/20 0.37
CNR1 P21554 1/20 0.37
CASP6 P55212 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HTT P42858 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
LMNA P02545 1/20 0.36
THRB P10828 1/20 0.36
PRKACA P17612 3/20 0.36
PRKACG P22612 3/20 0.36
PRKACB P22694 3/20 0.36

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
SCHEMBL4914997 0.88 CYP11B2 (0.48) CYP11B2HDAC1SCN9ACYP11B1CNR2
SCHEMBL2656820 0.82 CYP11B2 (0.51) CYP11B2SCN9ACYP11B1CNR2ALDH1A1
SCHEMBL2659090 0.79 CYP11B2 (0.39) CYP11B2HDAC1SCN9ACYP11B1CNR2
SCHEMBL2656404 0.79 CYP11B2 (0.39) CYP11B2HDAC1SCN9ACYP11B1CNR2
SCHEMBL2658369 0.79 CYP11B2 (0.39) CYP11B2HDAC1SCN9ACYP11B1PLAUR
SCHEMBL2668182 0.79 CYP11B2 (0.39) CYP11B2HDAC1SCN9ACYP11B1CNR2
SCHEMBL2657440 0.76 BRD4 (0.40) CYP11B2SCN9AALDH1A1ADORA2AKDM4E
SCHEMBL10061101 0.74 SLC22A12 (0.48) CYP11B2SCN9ACNR2
SCHEMBL14141241 0.74 PLAUR (0.47) PLAURALDH1A1NPSR1TDP1KDM4E
SCHEMBL5072719 0.73 TDP1 (0.48) CYP11B2CYP11B1ALDH1A1TDP1KDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110301155-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-12-08 US disclosed
US-20110301155-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-12-08 US disclosed
US-20110301155-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-12-08 US disclosed
EP-2157859-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE Takeda Pharmaceutical Company Limited (JP) 2010-03-03 EP disclosed
WO-2008156757-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-24 WO disclosed
WO-2008156757-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-24 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-20110301155-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE GCKR, GCK, KHK CYP11B2 2151/4885HDAC1 238/4885SCN9A 2180/4885

“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.