SCHEMBL6433478

SCHEMBL6433478

COCOc1ccc(C2CCCC(NS(C)(=O)=O)C2)c(OCOC)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.35
SCN9A Q15858 2/20 0.33
TP53 P04637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CHEK1 O14757 1/20 0.33
AURKA O14965 1/20 0.33
DAPK3 O43293 1/20 0.33
JAK2 O60674 1/20 0.33
ABL1 P00519 1/20 0.33
NTRK1 P04629 1/20 0.33
FYN P06241 1/20 0.33
CSF1R P07333 1/20 0.33
RET P07949 1/20 0.33
IGF1R P08069 1/20 0.33
MET P08581 1/20 0.33
PDGFRB P09619 1/20 0.33

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
SCHEMBL6434919 0.84 CNR2 (0.33) ROR1PTGDR2MEN1KMT2A
SCHEMBL6434910 0.84 CNR2 (0.33) ROR1PTGDR2MEN1KMT2A
SCHEMBL6434913 0.84 CNR2 (0.33) ROR1PTGDR2MEN1KMT2A
SCHEMBL6437898 0.83 MTNR1A (0.41) ALDH1A1GSK3AGSK3BCDK9KDM4E
SCHEMBL6434678 0.78 ADORA2A (0.35) TP53ALDH1A1FYNCDK9KDM4E
SCHEMBL6437950 0.76 PTGDR2 (0.40) ALDH1A1ROR1PDE4APDE4BPDE4C
SCHEMBL6485121 0.76 POLB (0.36) ALDH1A1HPGDMMP2MMP9PTGDR2
SCHEMBL6437915 0.76 PARP15 (0.36) FYNROR1PTGDR2
SCHEMBL6435769 0.76 PARP15 (0.38) ALDH1A1FYNROR1PTGDR2
SCHEMBL6434817 0.74 MTNR1A (0.40) ALDH1A1HPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6933319-B2 Resorcinol derivatives PFIZER INC. (US) 2005-08-23 US disclosed
EP-1165495-B1 RESORCINOL DERIVATIVES PFIZER (US) 2005-04-20 EP disclosed
US-6828460-B2 Containing at least one ester, oxime, sulfonamide, hydroxyamino or alkyoxyamino functionality; skin lightening agents; tyrosinase inhibitors PFIZER INC. 2004-12-07 US disclosed
US-20040209949-A1 Resorcinol derivatives BROWNING ANDREW FRANCIS (SE) 2004-10-21 US disclosed
US-20020161041-A1 Resorcinol derivatives PFIZER INC. 2002-10-31 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-20040209949-A1 Resorcinol derivatives NQO1, LRAT, ALDH1A2 GLA 227/4885SCN9A 4002/4885TP53 3407/4885
US-20020161041-A1 Resorcinol derivatives NQO1, LRAT, ALDH1A2 GLA 227/4885SCN9A 4002/4885TP53 3407/4885

“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.