SCHEMBL1000093

SCHEMBL1000093

CCOC(=O)CSCc1csc(NC(=O)N(C2CCCCC2)C2CCCCC2)n1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
SMN1; SMN2 Q16637 5/20 0.48
POLB P06746 2/20 0.46
GAA P10253 1/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.43
LMNA P02545 2/20 0.43
MAPK1 P28482 3/20 0.42
TSHR P16473 2/20 0.42
HTT P42858 1/20 0.42
USP2 O75604 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL2606480 0.91 AVPR1B (0.42) ALDH1A1TDP1SMN1; SMN2POLBLMNA
SCHEMBL999454 0.88 ALDH1A1 (0.66) ALDH1A1TDP1SMN1; SMN2POLBGAA
SCHEMBL999175 0.86 ALDH1A1 (0.41) ALDH1A1TDP1SMN1; SMN2POLBLMNA
SCHEMBL2649302 0.81 RAB9A (0.39) ALDH1A1TDP1SMN1; SMN2POLBLMNA
SCHEMBL999058 0.79 SMN1; SMN2 (0.48) ALDH1A1TDP1SMN1; SMN2POLBGAA
SCHEMBL998640 0.79 SMN1; SMN2 (0.71) ALDH1A1TDP1SMN1; SMN2POLBGAA
SCHEMBL998689 0.79 RAB9A (0.46) ALDH1A1TDP1SMN1; SMN2GAALMNA
SCHEMBL13668437 0.79 SMN1; SMN2 (0.43) ALDH1A1TDP1SMN1; SMN2POLBHPGD
SCHEMBL998360 0.78 RAB9A (0.43) ALDH1A1TDP1SMN1; SMN2LMNATSHR
SCHEMBL999556 0.77 RAB9A (0.42) ALDH1A1TDP1SMN1; SMN2LMNATSHR

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
EP-2444397-A1 Heteroaryl-ureas and their use as glucokinase activators Novo Nordisk A/S (DK) 2012-04-25 EP disclosed
US-20110060019-A1 HETEROARYL-UREAS AND THEIR USE AS GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2011-03-10 US disclosed
US-7872139-B2 e.g.1,1-Dicyclohexyl-3-[5-(pyridin-2-ylsulfanyl)-thiazol-2-yl]-urea; useful for the management, treatment, control, or adjunct treatment of diseases, where increasing glucokinase activity is beneficial, in particular, type 2 diabetes NOVO NORDISK A/S (DK) 2011-01-18 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-20110060019-A1 HETEROARYL-UREAS AND THEIR USE AS GLUCOKINASE ACTIVATORS GCK, HK1, HK2 ALDH1A1 1548/4885TDP1 2912/4885SMN1; SMN2 3633/4885

“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.