SCHEMBL6068056

SCHEMBL6068056

CCNC(=O)Nc1nc2cc(Cl)c(F)cc2s1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.57
▸ RAB9A P51151 3/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ ABL1 P00519 11/20 0.56
▸ PIK3CD O00329 1/20 0.50
▸ PIK3CA P42336 1/20 0.48
▸ PIK3CG P48736 1/20 0.48
▸ DYRK1A Q13627 2/20 0.46
▸ FSCN1 Q16658 1/20 0.46
▸ PTPN1 P18031 1/20 0.45

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
SCHEMBL13798157 0.88 NPC1 (0.57) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL13798160 0.86 NPC1 (0.59) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL3661653 0.85 NPC1 (0.57) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL4496509 0.84 NPC1 (0.69) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL6067997 0.81 DYRK1A (0.71) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL14824329 0.80 NPC1 (0.64) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL6067968 0.80 NPC1 (0.54) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL12997528 0.78 NPC1 (0.49) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL3662009 0.78 ABL1 (0.53) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL3664440 0.77 NPC1 (0.60) NPC1RAB9ASMN1; SMN2ABL1PIK3CD

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 NPC1 3594/4885RAB9A 3285/4885SMN1; 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.

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