SCHEMBL1417865

SCHEMBL1417865

CC(C)(Oc1ccc(Cl)cc1)C(=O)NN

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 6/20 0.65
ALDH1A1 P00352 2/20 0.64
CYP1A2 P05177 4/20 0.64
CYP3A4 P08684 4/20 0.64
CYP2C19 P33261 3/20 0.64
CYP2D6 P10635 2/20 0.64
MAPT P10636 2/20 0.64
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
CYP2C9 P11712 2/20 0.60
HSD11B1 P28845 3/20 0.57
HSD11B2 P80365 1/20 0.57
FABP2 P12104 1/20 0.55
PPARG P37231 1/20 0.55
SLC22A12 Q96S37 1/20 0.55
ABCB11 O95342 1/20 0.55
TSHR P16473 1/20 0.55
HTR2A P28223 1/20 0.55
PMP22 Q01453 1/20 0.55
POLB P06746 2/20 0.54

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
SCHEMBL22221537 0.92 PPARA (0.68) PPARAALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL7987569 0.84 ALDH1A1 (0.47) PPARAALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL7991793 0.84 CA1 (0.53) PPARAALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL7983811 0.83 EPHX2 (0.50) PPARAALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL1417538 0.83 ALDH1A1 (0.49) PPARAALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL2610067 0.81 CYP1A2 (0.81) PPARAALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL7991799 0.81 OGG1 (0.55) PPARAALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL626124 0.80 PPARA (0.70) PPARAALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL1417819 0.80 ALDH1A1 (0.56) PPARAALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL1585228 0.80 POLB (0.58) PPARAALDH1A1CYP1A2CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024148259-A1 METHODS AND COMPOSITIONS FOR TREATING HSD-1-MEDIATED DISORDERS SPARROW PHARMACEUTICALS, INC. (US) 2024-07-11 WO disclosed
CN-114835656-A 1,3, 4-oxadiazole ethyl acetate and synthesis method thereof 天津中医药大学 2022-08-02 CN disclosed
EP-2298747-B1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2016-12-28 EP disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
EP-2298747-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-03-23 EP disclosed
EP-2298747-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-03-23 EP disclosed
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 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 (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-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF HSD11B1, HSD11B2, HSD3B1 PPARA 455/4885ALDH1A1 359/4885CYP1A2 320/4885

“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.