SCHEMBL6985206

SCHEMBL6985206

Nc1nc2cc(C(=O)O)ccc2s1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.68
RAB9A P51151 4/20 0.68
SMN1; SMN2 Q16637 3/20 0.68
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 4/20 0.50
LMNA P02545 3/20 0.50
GAA P10253 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
POLB P06746 2/20 0.50
MAPT P10636 2/20 0.50
HPGD P15428 2/20 0.50
NFKB1 P19838 2/20 0.50
NFKB2 Q00653 2/20 0.50
RELA Q04206 2/20 0.50
MITF O75030 1/20 0.50
RECQL P46063 1/20 0.50
GFER P55789 1/20 0.50
PAX8 Q06710 1/20 0.50
KLF5 Q13887 1/20 0.50
PIK3CD O00329 1/20 0.49

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
SCHEMBL211024 0.86 RAB9A (0.66) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL9185252 0.85 RAB9A (0.53) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL31132400 0.85 RAB9A (0.53) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
Hydrochloric Acid SCHEMBL4680538 0.85 RAB9A (0.64) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
Bromide SCHEMBL10947640 0.85 RAB9A (0.64) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL19029204 0.83 HDAC6 (0.67) NPC1RAB9AALDH1A1LMNACYP2D6
SCHEMBL10650359 0.81 SMN1; SMN2 (0.49) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL1121708 0.81 CYP3A4 (0.57) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL31119848 0.81 THRB (0.56) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL25252536 0.81 NPC1 (0.70) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E

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
CN-103103586-B The copper electroplating solution that contains thiazole compound SHAANXI NORMAL UNIVERSITY (CN) 2016-05-04 CN claimed
CN-103103586-A Thiazole compound-containing copper electroplating solution UNIV SHAANXI NORMAL 2013-05-15 CN claimed
EP-4400505-A1 PEPTIDE-UREA DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING SAME AND APPLICATION THEREOF Bivision Pharmaceuticals, Inc (CN) 2024-07-17 EP disclosed
CN-107892823-B One kind is suitable for the anhydrous woolen dyed disperse dyes and preparation method thereof of supercritical carbon dioxide with azobenzthiazole structure DALIAN POLYTECHNIC UNIVERSITY (CN) 2019-10-29 CN disclosed
US-20180312493-A1 Antibiotic Compounds, Pharmaceutical Formulations Thereof And Methods And Uses Therefor CENTRE FOR DRUG RESEARCH AND DEVELOPMENT (CA) 2018-11-01 US disclosed
CN-107892823-A One kind is suitable for anhydrous woolen dyed disperse dyes of supercritical carbon dioxide and preparation method thereof with azobenzthiazole structure 大连工业大学 2018-04-10 CN disclosed
CN-103103586-B The copper electroplating solution that contains thiazole compound SHAANXI NORMAL UNIVERSITY (CN) 2016-05-04 CN disclosed
CN-103103586-A Thiazole compound-containing copper electroplating solution UNIV SHAANXI NORMAL 2013-05-15 CN disclosed
EP-1177194-B1 4-(3',4'-HETEROCYCLYL BENZOYL) PYRAZOLES AS HERBICIDAL AGENTS BASF AG (DE) 2003-09-17 EP disclosed
US-6589915-B1 The invention relates to cyclohexenone derivatives of benzo-condensed, unsaturated 5-ring nitrogen heterocycles of general formula (I) wherein X represents N or a group C-R3, Y represents O, S, SO, SO2 or NR4 or X-Y represent S BASF AKTIENGESELLSCHAFT (DE) 2003-07-08 US disclosed
US-6541423-B1 Controlling vegatation BASF AKTIENGESELLSCHAFT (DE) 2003-04-01 US disclosed
EP-1177179-A1 BENZOHETERO CYCLYLCYCLO HEXENONES AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2002-02-06 EP disclosed
EP-1177194-A1 4-(3',4'-HETEROCYCLYL BENZOYL) PYRAZOLES AS HERBICIDAL AGENTS BASF AKTIENGESELLSCHAFT (DE) 2002-02-06 EP disclosed
WO-2000068228-A1 4-(3',4'-HETEROCYCLYL BENZOYL) PYRAZOLES AS HERBICIDAL AGENTS BASF AKTIENGESELLSCHAFT (DE) 2000-11-16 WO disclosed
WO-2000068210-A1 BENZOHETERO CYCLYLCYCLO HEXENONES AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-11-16 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-20180312493-A1 Antibiotic Compounds, Pharmaceutical Formulations Thereof And Methods And Uses Therefor UGT1A8, CYP2C8, CXCL8 NPC1 52/4885RAB9A 663/4885SMN1; SMN2 4665/4885

“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.