SCHEMBL4601280

SCHEMBL4601280

COc1ccccc1N(C(=O)O)c1ccccc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 2/20 0.50
TLR9 Q9NR96 1/20 0.50
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
CA12 O43570 2/20 0.48
CA7 P43166 2/20 0.48
CA9 Q16790 2/20 0.48
CA14 Q9ULX7 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
POLB P06746 1/20 0.47
CA4 P22748 1/20 0.46
KMT2A Q03164 1/20 0.46
HTT P42858 1/20 0.46
PTGIR P43119 1/20 0.45
LMNA P02545 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
JAK2 O60674 1/20 0.44
MITF O75030 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL713040 0.91 PTGIR (0.51) PAX8TLR9CA1CA2CA12
SCHEMBL22879480 0.82 PAX8 (0.52) PAX8TLR9CA1CA2CA12
SCHEMBL10424602 0.82 CA1 (0.50) PAX8TLR9CA1CA2CA12
SCHEMBL8779753 0.82 TSPO (0.53) PAX8TLR9CA1CA2CA12
SCHEMBL30743858 0.82 PAX8 (0.52) PAX8TLR9CA1CA2CA12
SCHEMBL31393778 0.82 PAX8 (0.56) PAX8TLR9CA1CA2CA12
SCHEMBL22879499 0.80 PTGIR (0.49) PAX8TLR9CA1CA2CA12
SCHEMBL23031179 0.79 PAX8 (0.47) PAX8TLR9CA1CA2CA12
SCHEMBL28773371 0.79 PTGIR (0.48) PAX8TLR9SMN1; SMN2POLBKMT2A
SCHEMBL8779567 0.78 KMT2A (0.49) PAX8TLR9CA1CA2CA12

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-8362017-B2 N-[5-chloro-2-(methyloxy)phenyl]-2-{[3-(1H-tetrazol-1-yl)phenyl]oxy}acetamide; antiproliferative agents; protein kinase inhibitors; drug screening EXELIXIS, INC. (US) 2013-01-29 US disclosed
US-7442698-B2 Substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2008-10-28 US disclosed
US-20080096892-A1 C-Kit Modulators And Methods Of Use EXELIXIS, INC. (US) 2008-04-24 US disclosed
US-20050026914-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-02-03 US 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-20080096892-A1 C-Kit Modulators And Methods Of Use KIT, PRKCH, PRKCB PAX8 2280/4885TLR9 1887/4885CA1 2225/4885
US-20050026914-A1 Substituted heterocyclic compounds and methods of use NFATC1, ICOS, BET1 PAX8 939/4885TLR9 459/4885CA1 280/4885

“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.