SCHEMBL23712445

SCHEMBL23712445

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
PKM P14618 1/20 0.37
P2RX7 Q99572 1/20 0.36
HTT P42858 1/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ACHE P22303 2/20 0.33
PYGL P06737 1/20 0.33
SLC22A12 Q96S37 1/20 0.33
ALOX5 P09917 1/20 0.33
OR51E2 Q9H255 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA3 P07451 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA7 P43166 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
SCHEMBL26418742 0.88 PKM (0.39) CYP4F2CYP4A11PKMMAPTACHE
SCHEMBL26416220 0.87 NPC1 (0.39) PKMACHEALOX5OR51E2MEN1
SCHEMBL26418778 0.85 MPO (0.39) MAPTSLC22A12MEN1KMT2AALDH1A1
SCHEMBL8022699 0.84 PTGS1 (0.34) PKMHTTMAPTACHESLC22A12
SCHEMBL26418764 0.82 FFAR1 (0.44) MAPTSLC22A12MEN1KMT2AALDH1A1
SCHEMBL26418733 0.82 APP (0.38) MAPTKDM4EACHEMEN1KMT2A
SCHEMBL26418791 0.81 PKM (0.34) PKMACHEKMT2AALDH1A1SMN1; SMN2
SCHEMBL30417256 0.81 ACHE (0.34) MAPTKDM4EACHEMEN1KMT2A
SCHEMBL29358995 0.81 SMN1; SMN2 (0.36) PKMMAPTKDM4EACHEMEN1
SCHEMBL23712620 0.81 ALDH1A1 (0.42) HTTMAPTACHEMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230127143-A1 METHOD FOR CONTROLLING PHAKOPSORA PACHYRHIZI HAVING RESISTANCE AGAINST QoI FUNGICIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-04-27 US disclosed
WO-2021153782-A1 METHOD FOR CONTROLLING PHAKOPSORA PACHYRHIZI HAVING RESISTANCE AGAINST QoI FUNGICIDE 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-20230127143-A1 METHOD FOR CONTROLLING PHAKOPSORA PACHYRHIZI HAVING RESISTANCE AGAINST QoI FUNGICIDE CYC1, COX5B, SQOR CYP4F2 383/4885CYP4A11 367/4885PKM 2530/4885

“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.