SCHEMBL3242216

SCHEMBL3242216

O=C(O)c1ccc2c(c1Cl)OCO2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
MAPK1 P28482 2/20 0.44
GRIK1 P39086 1/20 0.44
KDM4C Q9H3R0 1/20 0.41
KMT2A Q03164 2/20 0.40
TSHR P16473 2/20 0.40
XDH P47989 1/20 0.40
SLC22A12 Q96S37 1/20 0.40
SRD5A2 P31213 1/20 0.40
AOC3 Q16853 2/20 0.40
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
KDM4E B2RXH2 2/20 0.39
POLB P06746 2/20 0.39
MAPT P10636 2/20 0.39
FABP3 P05413 1/20 0.39
FABP4 P15090 1/20 0.39
FABP5 Q01469 1/20 0.39
GAA P10253 1/20 0.38

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
SCHEMBL9349416 0.85 ALDH1A1 (0.47) ALDH1A1MAPK1GRIK1KDM4CKMT2A
SCHEMBL25082789 0.84 AOC3 (0.42) ALDH1A1KMT2AAOC3RAB9ANPC1
SCHEMBL3542790 0.80 MAPT (0.44) ALDH1A1MAPK1KMT2ATSHRAOC3
SCHEMBL24069997 0.80 ACVRL1 (0.43) ALDH1A1KMT2ATSHRAOC3SMN1; SMN2
SCHEMBL6616047 0.80 MAPK1 (0.46) ALDH1A1MAPK1GRIK1KDM4CXDH
SCHEMBL9489186 0.80 ALDH1A1 (0.46) ALDH1A1MAPK1GRIK1KDM4CKMT2A
SCHEMBL7853968 0.79 ALDH1A1 (0.44) ALDH1A1MAPK1GRIK1KDM4CKMT2A
SCHEMBL2427291 0.79 ALDH1A1 (0.44) ALDH1A1MAPK1GRIK1KDM4CXDH
SCHEMBL9349254 0.79 ALDH1A1 (0.44) ALDH1A1MAPK1GRIK1KDM4CKMT2A
SCHEMBL667829 0.79 MAPK1 (0.44) ALDH1A1MAPK1GRIK1KDM4CKMT2A

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 10 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-7741479-B2 Urea inhibitors of MAP kinases LOCUS PHARMACEUTICALS, INC. (US) 2010-06-22 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-1828169-A2 UREA INHIBITORS OF MAP KINASES Locus Pharmaceuticals, Inc. (US) 2007-09-05 EP 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
US-20060167247-A1 Urea inhibitors of MAP kinases LOCUS PHARMACEUTICALS, INC. 2006-07-27 US disclosed
WO-2006062982-A2 UREA INHIBITORS OF MAP KINASES LOCUS PHARMACEUTICALS, INC. (US) 2006-06-15 WO 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 (3 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 ALDH1A1 2612/4885MAPK1 4218/4885GRIK1 4782/4885
US-20060199838-A1 Substituted N-aryl benzamides and related compounds for treatment of amyloid diseases and synucleinopathies IAPP, SNCA, BACE2 ALDH1A1 2671/4885MAPK1 4463/4885GRIK1 4752/4885
US-20060167247-A1 Urea inhibitors of MAP kinases MAPK1, MAP3K1, MAP3K20 ALDH1A1 2027/4885MAPK1 1/4885GRIK1 2842/4885

“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.