SCHEMBL3234337

SCHEMBL3234337

COc1cc(C(=O)Nc2ccc3c(c2)OCO3)ccc1NS(C)(=O)=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 16/20 0.72
▸ NPC1 O15118 15/20 0.72
▸ SMN1; SMN2 Q16637 9/20 0.72
▸ TP53 P04637 4/20 0.72
▸ PKM P14618 2/20 0.72
▸ MAPT P10636 8/20 0.62
▸ KDM4E B2RXH2 2/20 0.62
▸ HSD17B10 Q99714 1/20 0.62
▸ HPGD P15428 1/20 0.61
▸ ALDH1A1 P00352 3/20 0.60
▸ NFKB1 P19838 1/20 0.60
▸ NFKB2 Q00653 1/20 0.60
▸ RELA Q04206 1/20 0.60
▸ NPSR1 Q6W5P4 1/20 0.60
▸ GAA P10253 2/20 0.60
▸ CASP3 P42574 1/20 0.57
▸ SENP7 Q9BQF6 1/20 0.57
▸ TSHR P16473 1/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ KMT2A Q03164 1/20 0.56

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
SCHEMBL3244264 0.96 RAB9A (0.67) RAB9ANPC1SMN1; SMN2TP53PKM
SCHEMBL3241511 0.89 RAB9A (0.69) RAB9ANPC1SMN1; SMN2TP53PKM
SCHEMBL3245157 0.86 ALDH1A1 (0.60) RAB9ANPC1SMN1; SMN2TP53MAPT
SCHEMBL3241519 0.83 ALDH1A1 (0.58) RAB9ANPC1SMN1; SMN2TP53MAPT
SCHEMBL13293301 0.81 NPC1 (0.80) RAB9ANPC1SMN1; SMN2TP53PKM
SCHEMBL3245109 0.81 ALDH1A1 (0.60) RAB9ANPC1SMN1; SMN2TP53MAPT
SCHEMBL13293346 0.80 ALDH1A1 (0.54) RAB9ANPC1SMN1; SMN2TP53MAPT
SCHEMBL27179885 0.80 ALDH1A1 (0.66) RAB9ANPC1SMN1; SMN2TP53PKM
SCHEMBL13293310 0.79 RAB9A (0.80) RAB9ANPC1SMN1; SMN2TP53PKM
SCHEMBL13293317 0.78 ALDH1A1 (0.57) RAB9ANPC1SMN1; SMN2TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7745490-B2 Substituted N-aryl benzamides and related compounds for treatment of amyloid diseases and synucleinopathies PROTEOTECH, INC. (US) 2010-06-29 — — US disclosed
US-7745490-B2 Substituted N-aryl benzamides and related compounds for treatment of amyloid diseases and synucleinopathies PROTEOTECH, INC. (US) 2010-06-29 — — US disclosed
EP-1751097-B1 SUBSTITUTED N-ARYL BENZAMIDES AND RELATED COMPOUNDS FOR TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES PROTEOTECH INC (US) 2009-12-30 — — EP disclosed
US-20090060838-A1 SUBSTITUTED N-ARYL BENZAMIDES AND RELATED COMPOUNDS FOR TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES PROTEOTECH INC. 2009-03-05 — — US disclosed
EP-1751097-A1 SUBSTITUTED N-ARYL BENZAMIDES AND RELATED COMPOUNDS FOR TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES Proteotech, Inc. (US) 2007-02-14 — — EP disclosed
US-20060199838-A1 Substituted N-aryl benzamides and related compounds for treatment of amyloid diseases and synucleinopathies PROTAMED, INC. 2006-09-07 — — US disclosed
WO-2005113489-A1 SUBSTITUTED N-ARYL BENZAMIDES AND RELATED COMPOUNDS FOR TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES PROTEOTECH, INC. (US) 2005-12-01 — — 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 (2 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-20090060838-A1 SUBSTITUTED N-ARYL BENZAMIDES AND RELATED COMPOUNDS FOR TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES IAPP, SNCA, BACE2 RAB9A 2958/4885NPC1 1032/4885SMN1; SMN2 24/4885
US-20060199838-A1 Substituted N-aryl benzamides and related compounds for treatment of amyloid diseases and synucleinopathies IAPP, SNCA, BACE2 RAB9A 2893/4885NPC1 1016/4885SMN1; SMN2 26/4885

“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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