SCHEMBL4640630

SCHEMBL4640630

CC1(C)CCOc2cc(OCC(=O)O)ccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.50
HNF4A P41235 1/20 0.50
HSD17B10 Q99714 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
KDM4E B2RXH2 1/20 0.48
GLA P06280 1/20 0.48
GAA P10253 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48
CYP26A1 O43174 4/20 0.47
CYP3A4 P08684 3/20 0.47
CYP26B1 Q9NR63 3/20 0.47
TSHR P16473 2/20 0.46
ALOX15 P16050 1/20 0.46
RARA P10276 2/20 0.44
RARB P10826 2/20 0.44
RARG P13631 2/20 0.44
PPARG P37231 1/20 0.43
MCL1 Q07820 1/20 0.43

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
SCHEMBL14502033 0.85 KDM4E (0.52) RXRAHNF4AHSD17B10ALDH1A1HPGD
SCHEMBL9200174 0.82 RXRA (0.50) RXRAHNF4ACYP26A1CYP3A4CYP26B1
SCHEMBL4640501 0.77 TRPV1 (0.44)
SCHEMBL4641423 0.77 DRD2 (0.41) RXRAHNF4AHSD17B10ALDH1A1HPGD
SCHEMBL2730198 0.77 TSHR (0.72) HSD17B10ALDH1A1HPGDKDM4EGLA
SCHEMBL31371868 0.77 DRD2 (0.41) RXRAHNF4AHSD17B10ALDH1A1HPGD
SCHEMBL4642231 0.77 HSD17B10 (0.60) RXRAHSD17B10ALDH1A1HPGDKDM4E
SCHEMBL23643892 0.76 TSHR (0.59) HSD17B10ALDH1A1HPGDKDM4EGLA
SCHEMBL4640520 0.75 HSD17B10 (0.65) RXRAHSD17B10ALDH1A1HPGDKDM4E
SCHEMBL3346290 0.75 RARB (0.64) RXRAHNF4ACYP26A1CYP3A4CYP26B1

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 8 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-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
US-7214824-B2 Substituted N-sulfonylaminobenzyl-2-phenoxyacetamide compounds as VR1 receptor agonists PFIZER INC. (US) 2007-05-08 US 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 RXRA 799/4885HNF4A 1091/4885HSD17B10 2884/4885

“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.