SCHEMBL2664522

SCHEMBL2664522

CNCc1csc(NC(=O)c2ccccc2)n1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.66
PDE5A O76074 2/20 0.66
NPC1 O15118 2/20 0.63
RAB9A P51151 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.59
CDK5 Q00535 8/20 0.58
CDK5R1 Q15078 8/20 0.58
PDE1A P54750 1/20 0.55
PDE1B Q01064 1/20 0.55
PDE1C Q14123 1/20 0.55
AOC3 Q16853 2/20 0.55
SCD O00767 1/20 0.55
KDM4A O75164 1/20 0.54
KDM4B O94953 1/20 0.54
ADORA3 P0DMS8 1/20 0.54
KDM5B Q9UGL1 1/20 0.54

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
SCHEMBL91391 0.86 KDM4E (0.69) KDM4EPDE5ANPC1RAB9ASMN1; SMN2
SCHEMBL2227204 0.83 KDM4E (0.69) KDM4EPDE5ANPC1RAB9ASMN1; SMN2
SCHEMBL2664517 0.83 KDM4E (0.69) KDM4EPDE5ANPC1RAB9ASMN1; SMN2
SCHEMBL27599948 0.83 KDM4E (0.78) KDM4EPDE5ANPC1RAB9ASMN1; SMN2
SCHEMBL6919140 0.82 KDM4E (0.64) KDM4EPDE5ANPC1RAB9ASMN1; SMN2
SCHEMBL367981 0.82 SMN1; SMN2 (0.51) KDM4EPDE5ANPC1RAB9ASMN1; SMN2
SCHEMBL5717620 0.81 KDM4E (0.74) KDM4EPDE5ANPC1RAB9ASMN1; SMN2
SCHEMBL27782868 0.81 AOC3 (0.74) KDM4EPDE5ANPC1RAB9ASMN1; SMN2
SCHEMBL27782870 0.80 SMN1; SMN2 (0.62) KDM4EPDE5ANPC1RAB9ASMN1; SMN2
SCHEMBL3653731 0.80 ROCK2 (0.61)

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 5 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-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US disclosed
US-7524957-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2009-04-28 US disclosed
US-20080207636-A1 Compounds Effecting Glucokinase ASTRAZENECA AB (SE) 2008-08-28 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 (2 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-20080207636-A1 Compounds Effecting Glucokinase GCKR, GCK, SLC5A2 KDM4E 2280/4885PDE5A 1080/4885NPC1 1139/4885
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE GCKR, GCK, SLC5A2 KDM4E 2280/4885PDE5A 1080/4885NPC1 1139/4885

“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.