SCHEMBL2664741

SCHEMBL2664741

C=CCOc1cccc(C(=O)Nc2nccs2)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.73
NPC1 O15118 7/20 0.73
SMN1; SMN2 Q16637 2/20 0.73
HPGD P15428 1/20 0.73
KCNK3 O14649 1/20 0.57
KCNK9 Q9NPC2 1/20 0.57
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
SIRT2 Q8IXJ6 1/20 0.56
NPSR1 Q6W5P4 1/20 0.53
RECQL P46063 1/20 0.53
SCD O00767 1/20 0.52
MAPT P10636 2/20 0.51
POLB P06746 1/20 0.51
ESR2 Q92731 1/20 0.51
HSD17B10 Q99714 1/20 0.51
MAPK1 P28482 1/20 0.51
LMNA P02545 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MAP1LC3B Q9GZQ8 1/20 0.49

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
SCHEMBL30099022 0.82 RAB9A (0.77) RAB9ANPC1SMN1; SMN2HPGDKCNK3
SCHEMBL27652020 0.80 RAB9A (0.74) RAB9ANPC1SMN1; SMN2HPGDKCNK3
SCHEMBL4755922 0.78 RAB9A (0.71) RAB9ANPC1SMN1; SMN2HPGDKCNK3
SCHEMBL13870298 0.78 NPC1 (0.46) RAB9ANPC1SMN1; SMN2HPGDMEN1
SCHEMBL7357499 0.77 NPC1 (0.68) RAB9ANPC1SMN1; SMN2HPGDKCNK3
SCHEMBL6919419 0.77 NPC1 (0.66) RAB9ANPC1SMN1; SMN2HPGDKCNK3
SCHEMBL6918739 0.77 RAB9A (0.66) RAB9ANPC1SMN1; SMN2HPGDKCNK3
SCHEMBL29639182 0.76 GAA (0.65) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL4290205 0.76 RAB9A (0.70) RAB9ANPC1SMN1; SMN2HPGDKCNK3
SCHEMBL27739695 0.76 NPC1 (0.70) RAB9ANPC1SMN1; SMN2HPGDKCNK3

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 3175/4885NPC1 1139/4885SMN1; SMN2 1886/4885

“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.