SCHEMBL4644879

SCHEMBL4644879

COCCOc1cc(OC(=O)O)ccc1C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.40
ALDH1A1 P00352 4/20 0.40
LMNA P02545 3/20 0.40
GAA P10253 3/20 0.40
NR1H4 Q96RI1 2/20 0.38
KMT2A Q03164 2/20 0.38
EPHX2 P34913 1/20 0.38
MEN1 O00255 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 4/20 0.38
MAPK1 P28482 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
ELANE P08246 1/20 0.36

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
SCHEMBL4644874 0.90 HTT (0.39) KDM4EALDH1A1LMNAGAANR1H4
SCHEMBL4640469 0.85 ELANE (0.44) KDM4EALDH1A1LMNAGAANR1H4
SCHEMBL4641630 0.85 SMN1; SMN2 (0.50) LMNANR1H4EPHX2SMN1; SMN2L3MBTL1
SCHEMBL13624072 0.82 HTT (0.43) KDM4EALDH1A1LMNAGAAKMT2A
SCHEMBL4641914 0.78 RBP4 (0.43) MRGPRX4
SCHEMBL14502009 0.78 GAA (0.46) KDM4EALDH1A1LMNAGAAKMT2A
SCHEMBL4640606 0.76 ALDH1A1 (0.43) KDM4EALDH1A1LMNAGAAKMT2A
SCHEMBL13624065 0.76 MAPK1 (0.41) KDM4EALDH1A1LMNAGAANR1H4
SCHEMBL28514869 0.76 KDM4E (0.43) KDM4EALDH1A1KMT2AEPHX2MEN1
SCHEMBL20741377 0.74 MAPK1 (0.45) KDM4EALDH1A1LMNAGAAKMT2A

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
EP-1824837-B1 SUBSTITUTED N-SULFONYLAMINOBENZYL-2-PHENOXY ACETAMIDE COMPOUNDS PFIZER (US) 2008-08-13 EP disclosed
EP-1824837-A1 SUBSTITUTED N-SULFONYLAMINOBENZYL-2-PHENOXY ACETAMIDE COMPOUNDS Pfizer, Inc. (US) 2007-08-29 EP disclosed
US-7214824-B2 Substituted N-sulfonylaminobenzyl-2-phenoxyacetamide compounds as VR1 receptor agonists PFIZER INC. (US) 2007-05-08 US disclosed
WO-2006051378-A1 SUBSTITUTED N-SULFONYLAMINOBENZYL-2-PHENOXY ACETAMIDE COMPOUNDS PFIZER JAPAN INC. (JP) 2006-05-18 WO disclosed
US-20060100460-A1 Substituted N-sulfonylaminobenzyl-2-phenoxyacetamide compounds as VR1 receptor agonists PFIZER, INC. 2006-05-11 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 (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-20060100460-A1 Substituted N-sulfonylaminobenzyl-2-phenoxyacetamide compounds as VR1 receptor agonists CNR1, AVPR1A, OPRL1 KDM4E 4801/4885ALDH1A1 987/4885LMNA 2299/4885

“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.