SCHEMBL2664685

SCHEMBL2664685

CC(=O)OCc1cc(OC(C)C)cc(C(=O)Nc2nncs2)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.47
LMNA P02545 2/20 0.46
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GCK P35557 5/20 0.39
AQP4 P55087 1/20 0.39
PTGDR Q13258 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA9 Q16790 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TSHR P16473 1/20 0.37

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
SCHEMBL2664674 0.85 RAB9A (0.59) RAB9ALMNAKDM4ENPC1SMN1; SMN2
SCHEMBL2664580 0.83 GCK (0.57) RAB9ANPC1SMN1; SMN2GCKHPGD
SCHEMBL13870295 0.81 RAB9A (0.49) RAB9ALMNAKDM4ENPC1SMN1; SMN2
SCHEMBL2664681 0.80 GCK (0.57) RAB9ALMNAKDM4ENPC1SMN1; SMN2
SCHEMBL18707636 0.77 GCK (0.49) RAB9ALMNAKDM4ENPC1SMN1; SMN2
SCHEMBL9071518 0.76 NPC1 (0.64) RAB9ALMNAKDM4ENPC1SMN1; SMN2
SCHEMBL2664898 0.75 GCK (0.54) RAB9ANPC1SMN1; SMN2GCK
SCHEMBL2664680 0.75 GCK (0.64) RAB9ALMNAKDM4EGCK
SCHEMBL1792464 0.74 KMT2A (0.46) GCKALDH1A1
SCHEMBL2664677 0.74 GCK (0.66) RAB9ALMNAKDM4EGCKTSHR

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-7951830-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2011-05-31 US disclosed
US-7951830-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2011-05-31 US disclosed
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US disclosed
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US disclosed
US-7390908-B2 Such as 2-[3,5-Di(2-chlorobenzyloxy)benzoyl)amino]-thiazole; for treatment of diabetes ASTRAZENECA AB (SE) 2008-06-24 US disclosed
US-7390908-B2 Such as 2-[3,5-Di(2-chlorobenzyloxy)benzoyl)amino]-thiazole; for treatment of diabetes ASTRAZENECA AB (SE) 2008-06-24 US 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-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE GCKR, GCK, SLC5A2 RAB9A 3175/4885LMNA 1802/4885KDM4E 2280/4885

“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.