SCHEMBL23717628

SCHEMBL23717628

CO/C=C(\Oc1cc(-c2ccccc2F)ccc1C)C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.41
ACMSD Q8TDX5 1/20 0.38
TNKS O95271 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
HDAC6 Q9UBN7 1/20 0.37
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CTSA P10619 1/20 0.36
PTPRC P08575 1/20 0.35
PTPN1 P18031 1/20 0.35
DHODH Q02127 4/20 0.35
CD274 Q9NZQ7 1/20 0.34
ABCB1 P08183 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PDK2 Q15119 1/20 0.34
SLC6A9 P48067 1/20 0.34
NPC1 O15118 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL30168597 1.00 ERN1 (0.41) ERN1ACMSDTNKSTNKS2HDAC6
SCHEMBL23732043 0.91 ERN1 (0.43) ERN1ACMSDTNKSTNKS2HDAC6
SCHEMBL23706396 0.89 ERN1 (0.42) ERN1ACMSDTNKSTNKS2HDAC6
SCHEMBL21675861 0.89 MCL1 (0.40) MAPTCTSAABCB1PDK2SLC6A9
SCHEMBL23717590 0.87 ERN1 (0.40) ERN1ACMSDHDAC6ALDH1A1MAPT
SCHEMBL30168601 0.87 ERN1 (0.40) ERN1ACMSDHDAC6ALDH1A1MAPT
SCHEMBL31423338 0.84 MEN1 (0.39) HDAC6ALDH1A1MAPTDHODH
SCHEMBL31387874 0.84 MEN1 (0.39) HDAC6ALDH1A1MAPTDHODH
SCHEMBL30784639 0.84 MEN1 (0.39) HDAC6ALDH1A1MAPTDHODH
SCHEMBL7783807 0.84 MEN1 (0.39) HDAC6ALDH1A1MAPTDHODH

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-20230130546-A1 PLANT DISEASE CONTROL COMPOSITION AND PLANT DISEASE CONTROL METHOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-04-27 US disclosed
US-20230130546-A1 PLANT DISEASE CONTROL COMPOSITION AND PLANT DISEASE CONTROL METHOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-04-27 US disclosed
WO-2021153760-A1 PLANT DISEASE CONTROL COMPOSITION AND PLANT DISEASE CONTROL METHOD 住友化学株式会社 2021-08-05 WO disclosed
WO-2021153759-A1 PLANT DISEASE CONTROL COMPOSITION AND PLANT DISEASE CONTROL METHOD 住友化学株式会社 2021-08-05 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-20230130546-A1 PLANT DISEASE CONTROL COMPOSITION AND PLANT DISEASE CONTROL METHOD FASTKD1, MT-CO1, MT-CO2 ERN1 3646/4885ACMSD 929/4885TNKS 4364/4885

“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.