SCHEMBL20595817

SCHEMBL20595817

COc1ccc(-n2ccc(=O)c3cc(F)c(CC(=O)O)cc32)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.42
▸ LCK P06239 1/20 0.42
▸ AKR1C3 P42330 6/20 0.41
▸ AKR1C2 P52895 4/20 0.41
▸ AKR1C4 P17516 2/20 0.41
▸ PTGS1 P23219 2/20 0.41
▸ HSD17B10 Q99714 1/20 0.40
▸ CYP2C9 P11712 4/20 0.38
▸ LMNA P02545 3/20 0.38
▸ CYP1A2 P05177 3/20 0.38
▸ PMP22 Q01453 3/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ BLM P54132 1/20 0.38
▸ MEN1 O00255 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ HIF1A Q16665 2/20 0.37

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
SCHEMBL20596259 0.85 MAOB (0.37) KDM4EHSD17B10LMNANPSR1MAPT
SCHEMBL20596021 0.81 LMNA (0.41) LMNAMAPTPTGES
SCHEMBL20596195 0.76 TAS1R3 (0.32) KDM4ELMNAMAPTKMT2AHIF1A
SCHEMBL30145274 0.75 MARS2 (0.47) ALDH1A1PTGES
SCHEMBL20595982 0.75 MARS2 (0.47) ALDH1A1PTGES
SCHEMBL5743085 0.69 HSD17B10 (0.68) KDM4ELCKAKR1C3AKR1C2PTGS1
SCHEMBL473881 0.69 HSD17B10 (0.63) KDM4ELCKAKR1C3AKR1C2AKR1C4
SCHEMBL1142783 0.69 HSD17B10 (0.63) KDM4ELCKAKR1C3AKR1C2PTGS1
SCHEMBL29431206 0.69 HSD17B10 (0.68) KDM4ELCKAKR1C3AKR1C2PTGS1
SCHEMBL473974 0.66 HSD17B10 (0.68) KDM4ELCKAKR1C3AKR1C2AKR1C4

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
US-11584744-B2 Inhibitors of type 1 methionyl-tRNA synthetase and methods of using them UNIVERSITY OF WASHINGTON (US) 2023-02-21 — — US disclosed
US-11584744-B2 Inhibitors of type 1 methionyl-tRNA synthetase and methods of using them UNIVERSITY OF WASHINGTON (US) 2023-02-21 — — US disclosed
US-20210155617-A1 INHIBITORS OF TYPE l METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM UNIVERSITY OF WASHINGTON 2021-05-27 — — US disclosed
US-20210155617-A1 INHIBITORS OF TYPE l METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM UNIVERSITY OF WASHINGTON 2021-05-27 — — US disclosed
WO-2018237349-A1 INHIBITORS OF TYPED 1 METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM UNIVERSITY OF WASHINGTON (US) 2018-12-27 — — 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 (2 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-11584744-B2 Inhibitors of type 1 methionyl-tRNA synthetase and methods of using them AARS1, EMG1, GARS1 KDM4E 1618/4885LCK 3882/4885AKR1C3 2397/4885
US-20210155617-A1 INHIBITORS OF TYPE l METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM AARS1, GARS1, MTR KDM4E 1423/4885LCK 3464/4885AKR1C3 2602/4885

“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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