SCHEMBL1566090

SCHEMBL1566090

CS(=O)(=O)c1ccc(C(SC2CCCC2)C(=O)Nc2ccccn2)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.44
▸ POLB P06746 1/20 0.44
▸ GCK P35557 3/20 0.43
▸ S1PR1 P21453 1/20 0.42
▸ S1PR3 Q99500 1/20 0.42
▸ ATR Q13535 1/20 0.42
▸ FFAR2 O15552 1/20 0.42
▸ NPC1 O15118 5/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ RAB9A P51151 4/20 0.40
▸ LMNA P02545 2/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39

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
SCHEMBL1565646 0.87 POLB (0.54) KDM4EPOLBS1PR1S1PR3FFAR2
SCHEMBL1565499 0.85 S1PR1 (0.45) KDM4EPOLBS1PR1S1PR3FFAR2
SCHEMBL1566102 0.85 S1PR1 (0.45) KDM4EPOLBS1PR1S1PR3FFAR2
SCHEMBL1564751 0.85 S1PR1 (0.60) KDM4EPOLBS1PR1S1PR3FFAR2
SCHEMBL1565276 0.85 RAB9A (0.48) KDM4EPOLBS1PR1S1PR3FFAR2
SCHEMBL1566012 0.84 NPC1 (0.47) KDM4EPOLBS1PR1S1PR3NPC1
SCHEMBL1565503 0.84 F2 (0.51) KDM4EPOLBS1PR1S1PR3FFAR2
SCHEMBL1566010 0.82 MAPT (0.44) KDM4EPOLBS1PR1S1PR3FFAR2
SCHEMBL1564998 0.82 S1PR1 (0.43) KDM4EPOLBS1PR1S1PR3FFAR2
SCHEMBL1565292 0.82 KDM4E (0.45) KDM4EPOLBS1PR1S1PR3FFAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2305648-A1 Amide derivatives useful as glucokinase activators Novo Nordisk A/S (DK) 2011-04-06 — — EP claimed
US-20030171411-A1 Amide derivatives as therapeutic agents NOVO NORDISK A/S (DK) 2003-09-11 — — US claimed
EP-2305648-A1 Amide derivatives useful as glucokinase activators Novo Nordisk A/S (DK) 2011-04-06 — — EP disclosed
EP-2305648-A1 Amide derivatives useful as glucokinase activators Novo Nordisk A/S (DK) 2011-04-06 — — EP disclosed
EP-1458382-A1 AMIDE DERIVATIVES AS GK ACTIVATORS NOVO NORDISK A/S (DK) 2004-09-22 — — EP disclosed
US-20030171411-A1 Amide derivatives as therapeutic agents NOVO NORDISK A/S (DK) 2003-09-11 — — US disclosed
WO-2003055482-A1 AMIDE DERIVATIVES AS GK ACTIVATORS NOVO NORDISK A/S (DK) 2003-07-10 — — WO disclosed
WO-2003055482-A1 AMIDE DERIVATIVES AS GK ACTIVATORS NOVO NORDISK A/S (DK) 2003-07-10 — — 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-20030171411-A1 Amide derivatives as therapeutic agents GK, GCKR, GCK KDM4E 1464/4885POLB 3388/4885GCK 3/4885

“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.

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