SCHEMBL20522192

SCHEMBL20522192

O=C(O)c1cc(F)ccc1OCC(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.46
KEAP1 Q14145 1/20 0.46
LCLAT1 Q6UWP7 1/20 0.44
MKNK2 Q9HBH9 1/20 0.42
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
ALDH1A1 P00352 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HTT P42858 2/20 0.40
FOLH1 Q04609 2/20 0.39
KMT2A Q03164 1/20 0.39
PTK2B Q14289 1/20 0.39
KCNH2 Q12809 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NTRK1 P04629 1/20 0.38
NTRK3 Q16288 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38

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
SCHEMBL31497183 0.83 GAA (0.60) LCLAT1GAATSHRALDH1A1SMN1; SMN2
SCHEMBL16448844 0.83 ABCB1 (0.48) LCLAT1GAATSHRMRGPRX4
SCHEMBL20522092 0.83 GAA (0.60) LCLAT1GAATSHRALDH1A1SMN1; SMN2
SCHEMBL16836611 0.81 ALDH1A1 (0.59) TSHRALDH1A1HTTKMT2APTK2B
SCHEMBL31078354 0.80 TSHR (0.56) PKMKEAP1GAATSHRKMT2A
SCHEMBL1188345 0.80 TSHR (0.56) PKMKEAP1GAATSHRKMT2A
SCHEMBL4138843 0.80 PKM (0.71) PKMKEAP1SMN1; SMN2HTTL3MBTL1
SCHEMBL20522110 0.79 PKM (0.47) PKMKEAP1GAATSHRALDH1A1
SCHEMBL31497192 0.79 PKM (0.47) PKMKEAP1GAATSHRALDH1A1
SCHEMBL23611727 0.78 KEAP1 (0.50) PKMKEAP1ALDH1A1SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12630541-B2 Compounds useful as inhibitors of ALCAT 1 PERENNA PHARMACEUTICALS, INC. (US) 2026-05-19 US disclosed
CN-120136858-A Compounds useful as ALCAT1 inhibitors 中美博瑞纳制药有限公司 2025-06-13 CN disclosed
CN-110709394-B Compounds useful as ALCAT1 inhibitors 中美博瑞纳制药有限公司 2025-02-21 CN disclosed
US-20220089582-A1 COMPOUNDS USEFUL AS INHIBITORS OF ALCAT 1 PERENNA PHARMACEUTICALS, INC. 2022-03-24 US disclosed
US-11208404-B2 Compounds useful as inhibitors of ALCAT 1 PERENNA PHARMACEUTICALS, INC. (US) 2021-12-28 US disclosed
US-20200109136-A1 COMPOUNDS USEFUL AS INHIBITORS OF ALCAT 1 PERENNA PHARMACEUTICALS, INC. 2020-04-09 US disclosed
EP-3601274-A1 COMPOUNDS USEFUL AS INHIBITORS OF ALCAT 1 Perenna Pharmaceuticals, Inc. (US) 2020-02-05 EP disclosed
CN-110709394-A Compounds useful as ALCAT1 inhibitors 中美博瑞纳制药有限公司 2020-01-17 CN disclosed
WO-2018178304-A1 COMPOUNDS USEFUL AS INHIBITORS OF ALCAT 1 PERENNA PHARMACEUTICALS, INC. (US) 2018-10-04 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 (4 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-20220089582-A1 COMPOUNDS USEFUL AS INHIBITORS OF ALCAT 1 ACAT1, ACAT2, SLC33A1 PKM 3051/4885KEAP1 1029/4885LCLAT1 5/4885
US-12630541-B2 Compounds useful as inhibitors of ALCAT 1 LCLAT1, LPCAT1, ACAT2 PKM 2614/4885KEAP1 2311/4885LCLAT1 1/4885
US-11208404-B2 Compounds useful as inhibitors of ALCAT 1 ACAT1, ACAT2, SLC33A1 PKM 3051/4885KEAP1 1029/4885LCLAT1 5/4885
US-20200109136-A1 COMPOUNDS USEFUL AS INHIBITORS OF ALCAT 1 ACAT1, ACAT2, SLC33A1 PKM 3051/4885KEAP1 1029/4885LCLAT1 5/4885

“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.