SCHEMBL2656790

SCHEMBL2656790

Cc1csc(C(=O)Nc2nccs2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.61
RAB9A P51151 11/20 0.61
SMN1; SMN2 Q16637 4/20 0.60
KMT2A Q03164 6/20 0.58
MEN1 O00255 5/20 0.58
PPARG P37231 1/20 0.56
NCOR2 Q9Y618 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.54
LMNA P02545 2/20 0.54
METAP2 P50579 1/20 0.54
METAP1 P53582 1/20 0.54
ALDH1A1 P00352 5/20 0.54
HPGD P15428 3/20 0.54
KDM4E B2RXH2 2/20 0.54
POLB P06746 2/20 0.54
MAPT P10636 1/20 0.54
BLM P54132 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
CASP3 P42574 1/20 0.53
SENP8 Q96LD8 1/20 0.53

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
SCHEMBL14018616 0.78 RAB9A (0.72) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL16073042 0.78 NPC1 (0.58) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL17644749 0.78 RAB9A (0.51) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL5733209 0.77 NPC1 (0.61) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL12124359 0.76 RAB9A (0.65) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL2657441 0.76 NPC1 (1.00) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL2659004 0.75 NPC1 (0.58) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL3223685 0.75 RAB9A (1.00) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL16073053 0.75 NPC1 (0.58) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL11780138 0.74 CASP3 (0.45) NPC1RAB9ASMN1; SMN2CASP3SENP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2244706-B1 GLUCOKINASE ACTIVATORS MERCK PATENT GMBH (DE) 2016-04-06 EP claimed
CN-101959515-B Glucokinase activators MERCK PATENT GMBH 2013-06-12 CN claimed
CN-101959515-A Glucokinase activators MERCK PATENT GMBH 2011-01-26 CN claimed
US-20100331338-A1 Glucokinase Activators MERCK PATENT GMBH (DE) 2010-12-30 US claimed
EP-2244706-A1 GLUCOKINASE ACTIVATORS Merck Patent GmbH (DE) 2010-11-03 EP claimed
WO-2009106203-A1 GLUCOKINASE ACTIVATORS MERCK PATENT GMBH (DE) 2009-09-03 WO claimed
EP-2244706-B1 GLUCOKINASE ACTIVATORS MERCK PATENT GMBH (DE) 2016-04-06 EP disclosed
CN-101959515-B Glucokinase activators MERCK PATENT GMBH 2013-06-12 CN disclosed
CN-101959515-A Glucokinase activators MERCK PATENT GMBH 2011-01-26 CN disclosed
US-20100331338-A1 Glucokinase Activators MERCK PATENT GMBH (DE) 2010-12-30 US disclosed
US-20100331338-A1 Glucokinase Activators MERCK PATENT GMBH (DE) 2010-12-30 US disclosed
US-20100331338-A1 Glucokinase Activators MERCK PATENT GMBH (DE) 2010-12-30 US disclosed
EP-2244706-A1 GLUCOKINASE ACTIVATORS Merck Patent GmbH (DE) 2010-11-03 EP disclosed
WO-2009106203-A1 GLUCOKINASE ACTIVATORS MERCK PATENT GMBH (DE) 2009-09-03 WO disclosed
WO-2009106203-A1 GLUCOKINASE ACTIVATORS MERCK PATENT GMBH (DE) 2009-09-03 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-20100331338-A1 Glucokinase Activators GCKR, HK1, GCK NPC1 1277/4885RAB9A 2651/4885SMN1; SMN2 1448/4885

“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.