SCHEMBL23649913

SCHEMBL23649913

CC(OC(=O)[C@H](C)NC(=O)OC(C)(C)C)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 2/20 0.44
▸ CTSK P43235 2/20 0.44
▸ GAA P10253 2/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ EPHX1 P07099 2/20 0.43
▸ HDAC4 P56524 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ CA12 O43570 3/20 0.42
▸ CA14 Q9ULX7 1/20 0.42
▸ CA1 P00915 3/20 0.39
▸ CA2 P00918 3/20 0.39
▸ CA7 P43166 1/20 0.39
▸ BTK Q06187 1/20 0.38
▸ AAK1 Q2M2I8 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ GLA P06280 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CACNA1B Q00975 1/20 0.36

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
SCHEMBL23649916 1.00 CTSS (0.44) CTSSCTSKGAAKMT2AEPHX1
SCHEMBL16492826 0.81 CA1 (0.47) CTSSCTSKGAAKMT2ACA12
SCHEMBL26276845 0.81 CACNA1B (0.47) CTSSCTSKGAAKMT2AEPHX1
SCHEMBL5322434 0.81 CACNA1B (0.47) CTSSCTSKGAAKMT2AEPHX1
SCHEMBL28854870 0.81 CACNA1B (0.47) CTSSCTSKGAAKMT2AEPHX1
SCHEMBL23270360 0.81 CACNA1B (0.47) CTSSCTSKGAAKMT2AEPHX1
SCHEMBL22338809 0.80 CA1 (0.51) CTSSCTSKGAAKMT2AEPHX1
SCHEMBL14037661 0.80 CA1 (0.51) CTSSCTSKGAAKMT2AEPHX1
SCHEMBL17905112 0.79 KMT2A (0.42) CTSSCTSKGAAKMT2AEPHX1
SCHEMBL10143849 0.79 CACNA1B (0.46) CTSSCTSKGAAKMT2AEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230131966-A1 FUNGICIDAL AMIDES FMC CORPORATION 2023-04-27 — — US disclosed
EP-4090651-A1 FUNGICIDAL AMIDES FMC CORPORATION (US) 2022-11-23 — — EP disclosed
CN-114945558-A Fungicidal amides FMC公司 2022-08-26 — — CN disclosed
WO-2021146522-A1 FUNGICIDAL AMIDES FMC CORPORATION (US) 2021-07-22 — — 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-20230131966-A1 FUNGICIDAL AMIDES ARG1, CYP1B1, NOX1 CTSS 1558/4885CTSK 2654/4885GAA 527/4885

“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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