SCHEMBL6067997

SCHEMBL6067997

CCNC(=O)Nc1nc2ccc(Cl)cc2s1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.71
FSCN1 Q16658 1/20 0.71
ABL1 P00519 9/20 0.70
NPC1 O15118 2/20 0.69
RAB9A P51151 2/20 0.69
SMN1; SMN2 Q16637 2/20 0.69
PTPN1 P18031 1/20 0.66
CASP3 P42574 5/20 0.62
SENP7 Q9BQF6 5/20 0.62
SENP8 Q96LD8 4/20 0.62
SENP6 Q9GZR1 4/20 0.62
PIK3CA P42336 1/20 0.59
PIK3CG P48736 1/20 0.59
PIK3CD O00329 1/20 0.58

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
SCHEMBL6068110 0.91 ABL1 (0.80) DYRK1AFSCN1ABL1NPC1RAB9A
SCHEMBL2790634 0.87 DYRK1A (0.64) DYRK1AFSCN1ABL1NPC1RAB9A
SCHEMBL14189671 0.86 ABL1 (0.70) DYRK1AABL1NPC1RAB9ASMN1; SMN2
SCHEMBL2791913 0.86 PTPN1 (0.69) DYRK1AFSCN1ABL1NPC1RAB9A
SCHEMBL1303393 0.85 RAB9A (0.69) DYRK1AABL1NPC1RAB9ASMN1; SMN2
SCHEMBL6068168 0.85 ABL1 (0.71) ABL1NPC1RAB9ASMN1; SMN2PIK3CA
SCHEMBL9893074 0.85 DYRK1A (0.72) DYRK1AFSCN1NPC1RAB9ASMN1; SMN2
Potassium Ion SCHEMBL2790230 0.85 DYRK1A (0.61) DYRK1AFSCN1ABL1NPC1RAB9A
SCHEMBL4496509 0.84 NPC1 (0.69) ABL1NPC1RAB9ASMN1; SMN2PIK3CA
SCHEMBL6068142 0.84 GSK3B (0.67) DYRK1AABL1NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7091227-B2 Benzothiazole derivatives ABBOTT GMBH & CO. KG (DE) 2006-08-15 US disclosed
US-20030153568-A1 Benzothiazole derivatives BASF AKTIENGESELLSCHAFT LUDWIGSHAFEN, GERMANY 2003-08-14 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-20030153568-A1 Benzothiazole derivatives TK1, FLT1, CDK1 DYRK1A 231/4885FSCN1 4525/4885ABL1 7/4885

“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.