SCHEMBL6068095

SCHEMBL6068095

CCNC(=O)Nc1nc2ccc(Cl)c(O)c2s1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.56
NPC1 O15118 4/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
ABL1 P00519 11/20 0.52
PIK3CA P42336 3/20 0.45
PIK3CG P48736 1/20 0.45
PIK3CD O00329 1/20 0.44
MAPK8 P45983 2/20 0.44
MAPK9 P45984 2/20 0.44
MAPK10 P53779 2/20 0.44
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL6067813 0.84 RAB9A (0.56) RAB9ANPC1SMN1; SMN2ABL1PIK3CA
SCHEMBL6067875 0.81 NPC1 (0.53) RAB9ANPC1SMN1; SMN2ABL1PIK3CA
SCHEMBL6067965 0.81 NPC1 (0.55) RAB9ANPC1SMN1; SMN2ABL1PIK3CA
SCHEMBL6067933 0.80 NPC1 (0.51) RAB9ANPC1SMN1; SMN2ABL1KDM4E
SCHEMBL6067902 0.80 NPC1 (0.48) RAB9ANPC1SMN1; SMN2ABL1PIK3CA
SCHEMBL6067936 0.80 NPC1 (0.68) RAB9ANPC1SMN1; SMN2ABL1PIK3CA
SCHEMBL6067997 0.77 DYRK1A (0.71) RAB9ANPC1SMN1; SMN2ABL1PIK3CA
SCHEMBL6068201 0.76 RAB9A (0.56) RAB9ANPC1SMN1; SMN2ABL1PIK3CA
SCHEMBL6068288 0.74 NPC1 (0.54) RAB9ANPC1SMN1; SMN2ABL1PIK3CA
SCHEMBL6068145 0.74 NPC1 (0.61) RAB9ANPC1SMN1; SMN2ABL1PIK3CA

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 4 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
EP-1254123-A1 2-BENZOTHIAZOLYL UREA DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS Abbott GmbH & Co. KG (DE) 2002-11-06 EP disclosed
WO-2001057008-A1 2-BENZOTHIAZOLYL UREA DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS ABBOTT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG & COMPANY KOMMANDITGESELLSCHAFT (DE) 2001-08-09 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-20030153568-A1 Benzothiazole derivatives TK1, FLT1, CDK1 RAB9A 3285/4885NPC1 3594/4885SMN1; SMN2 4285/4885

“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.