SCHEMBL2667405

SCHEMBL2667405

Nc1ncc(Oc2cccc(Cl)c2)s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAP4K4 O95819 1/20 0.43
SLC9A1 P19634 1/20 0.43
EGFR P00533 2/20 0.42
ICAM1 P05362 1/20 0.41
SELE P16581 1/20 0.41
VCAM1 P19320 1/20 0.41
SCN5A Q14524 1/20 0.41
SCN9A Q15858 1/20 0.41
CDK8 P49336 1/20 0.40
WDR5 P61964 1/20 0.40
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
PDE4B Q07343 1/20 0.37
LCK P06239 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
DHFR P00374 1/20 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
SCHEMBL21384250 0.81 MAP4K4 (0.43) MAP4K4CDK8DCPS
SCHEMBL29442841 0.81 MAP4K4 (0.43) MAP4K4CDK8DCPS
SCHEMBL10329783 0.81 ALDH1A1 (0.50) CYP1A2CYP2C9CYP2C19MAP4K4CDK8
SCHEMBL2667719 0.81 RAB9A (0.41) CYP2C9L3MBTL1
SCHEMBL2667220 0.78 MAP4K4 (0.46) MAP4K4PDE4B
SCHEMBL31104729 0.75 NOS1 (0.36) WDR5
SCHEMBL210658 0.74 LMNA (0.49) MAP4K4
SCHEMBL2667226 0.74 L3MBTL1 (0.50) L3MBTL1
SCHEMBL5149605 0.72 MAPT (0.42) ICAM1SELEL3MBTL1
SCHEMBL4463834 0.71 CDK8 (0.67) CYP1A2CYP2C9CYP2C19SCN5ASCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8222285-B2 1,3-dihydroxy substituted phenylamide glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2012-07-17 US disclosed
US-20100179121-A1 1,3-DIHYDROXY SUBSTITUTED PHENYLAMIDE GLUCOKINASE ACTIVATORS BRISTOL-MEYERS SQUIBB COMPANY 2010-07-15 US disclosed
WO-2008154563-A1 1, 3 - DIHYDROXY SUBSTITUTED PHENYLAMIDE GLUCOKINASE ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-12-18 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-20100179121-A1 1,3-DIHYDROXY SUBSTITUTED PHENYLAMIDE GLUCOKINASE ACTIVATORS GCKR, GCK, NR4A3 CYP1A2 2324/4885CYP2C9 1034/4885CYP2C19 2661/4885

“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.