SCHEMBL26709501

SCHEMBL26709501

O=C1S/C(=C\c2ccc(F)c(O)c2)C(=O)N1Cc1cccc(OC(F)(F)F)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 1/20 0.60
▸ PPARG P37231 3/20 0.52
▸ NLRP3 Q96P20 1/20 0.52
▸ MEN1 O00255 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ CRHBP P24387 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ CRHR2 Q13324 1/20 0.51
▸ NOD2 Q9HC29 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ ENPP2 Q13822 3/20 0.49
▸ PTPN1 P18031 4/20 0.48
▸ ACP1 P24666 4/20 0.48
▸ PTPN2 P17706 1/20 0.48

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
SCHEMBL29411695 1.00 PIM1 (0.60) PIM1PPARGNLRP3MEN1ALDH1A1
SCHEMBL26709466 0.85 NLRP3 (0.71) PIM1PPARGNLRP3MEN1ALDH1A1
SCHEMBL28979066 0.85 NLRP3 (0.71) PIM1PPARGNLRP3MEN1ALDH1A1
SCHEMBL29411713 0.85 PTPN1 (0.60) PPARGNLRP3MEN1ALDH1A1POLB
SCHEMBL28979085 0.85 PTPN1 (0.60) PPARGNLRP3MEN1ALDH1A1POLB
SCHEMBL26709485 0.85 PTPN1 (0.60) PPARGNLRP3MEN1ALDH1A1POLB
SCHEMBL26606767 0.84 MEN1 (0.64) PIM1PPARGMEN1POLBMAPK1
SCHEMBL17059998 0.83 PIM1 (0.62) PIM1PPARGNLRP3MEN1ALDH1A1
SCHEMBL15682754 0.83 PIM1 (0.62) PIM1PPARGNLRP3MEN1ALDH1A1
SCHEMBL29411674 0.82 ENPP2 (0.53) PIM1PPARGNLRP3MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230339871-A1 COMPOUNDS AND METHODS OF MODULATING 17B-HYDROXYSTEROID DEHYDROGENASE TYPE 13 METREA BIOSCIENCES INC (US) 2023-10-26 — — US claimed
US-20230339871-A1 COMPOUNDS AND METHODS OF MODULATING 17B-HYDROXYSTEROID DEHYDROGENASE TYPE 13 METREA BIOSCIENCES INC (US) 2023-10-26 — — US disclosed
US-20230339871-A1 COMPOUNDS AND METHODS OF MODULATING 17B-HYDROXYSTEROID DEHYDROGENASE TYPE 13 METREA BIOSCIENCES INC (US) 2023-10-26 — — US disclosed
US-20230339871-A1 COMPOUNDS AND METHODS OF MODULATING 17B-HYDROXYSTEROID DEHYDROGENASE TYPE 13 METREA BIOSCIENCES INC (US) 2023-10-26 — — US disclosed
EP-4200286-A1 COMPOUNDS AND METHODS OF MODULATING 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 Metrea Biosciences, Inc. (US) 2023-06-28 — — EP disclosed
CN-115916762-A Compounds and methods for modulating 17 beta-hydroxysteroid dehydrogenase type 13 梅特雷亚生物科学股份有限公司 2023-04-04 — — CN disclosed
WO-2022040324-A1 COMPOUNDS AND METHODS OF MODULATING 17β-ΗYDROXYSTEROID DEHYDROGENASE TYPE 13 METREA BIOSCIENCES, INC. (US) 2022-02-24 — — 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-20230339871-A1 COMPOUNDS AND METHODS OF MODULATING 17B-HYDROXYSTEROID DEHYDROGENASE TYPE 13 HSD17B1, HSD17B13, HSD17B11 PIM1 4359/4885PPARG 871/4885NLRP3 4754/4885

“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.

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