SCHEMBL3901331

SCHEMBL3901331

COc1cccc2c1C(O)OC2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.44
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ACHE P22303 1/20 0.42
TOP1 P11387 1/20 0.42
EGFR P00533 1/20 0.41
PIM1 P11309 1/20 0.41
PTPRF P10586 1/20 0.41
TCF4 P15884 1/20 0.40
CTNNB1 P35222 1/20 0.40
NQO1 P15559 1/20 0.40
POR P16435 1/20 0.40
KDM4E B2RXH2 2/20 0.40
NR3C1 P04150 1/20 0.39
HTT P42858 2/20 0.39
CA12 O43570 1/20 0.39

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
SCHEMBL20552496 1.00 AR (0.44) ARCA1CA2CA7CA9
SCHEMBL87129 0.83 ACHE (0.43) CA1CA2CA7CA9MEN1
SCHEMBL6584591 0.80 MAPT (0.46) ARMEN1KMT2APTPRFKDM4E
SCHEMBL3782017 0.80 PTPRF (0.46) ARKMT2AACHEPTPRFKDM4E
SCHEMBL11394821 0.79 NQO1 (0.43) CA1CA2CA7CA9MEN1
SCHEMBL675985 0.79 KDM4E (0.62) ARCA1CA2CA7CA9
SCHEMBL2809659 0.77 KDM4E (0.68) ARMEN1KMT2AKDM4EHTT
SCHEMBL3902371 0.77 MAP3K14 (0.40) ARCA1CA2CA7CA9
SCHEMBL10495516 0.74 AKT1 (0.48) MEN1KMT2AACHETOP1EGFR
SCHEMBL19807346 0.74 MAOA (0.42) ARCA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110785413-B Pyrimidinoxybenzo-fused compounds as herbicides FMC公司 2024-08-02 CN disclosed
EP-3619206-B1 PYRIMIDINYLOXY BENZO-FUSED COMPOUNDS AS HERBICIDES FMC CORP (US) 2024-02-14 EP disclosed
US-11427549-B2 Pyrimidinyloxy benzo-fused compounds as herbicides FMC CORPORATION (US) 2022-08-30 US disclosed
US-20200055826-A1 PYRIMIDINYLOXY BENZO-FUSED COMPOUNDS AS HERBICIDES FMC CORPORATION 2020-02-20 US disclosed
CN-110785413-A Pyrimidinyloxybenzo-fused compounds as herbicides FMC公司 2020-02-11 CN disclosed
WO-2009145721-A1 ISOINDOLINE DERIVATIVES COMPRISING PHENYL GROUPS AND THEIR USE IN THE TREATMENT OF PAIN DISORDERS ASTRAZENECA AB (SE) 2009-12-03 WO disclosed
WO-2009145719-A1 ISOINDOLINE DERIVATIVES COMPRISING A CYANO GROUP AND THEIR USE IN THE TREATMENT OF PAIN DISORDERS ASTRAZENECA AB (SE) 2009-12-03 WO disclosed
WO-2009145718-A1 ISOINDOLINE DERIVATIVES COMPRISING AN ADDITIONAL HETEROCYCLIC GROUP AND THEIR USE IN THE TREATMENT OF PAIN DISORDERS ASTRAZENECA AB (SE) 2009-12-03 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-11427549-B2 Pyrimidinyloxy benzo-fused compounds as herbicides DDT, CNPY2, CBR3 AR 3598/4885CA1 2161/4885CA2 556/4885
US-20200055826-A1 PYRIMIDINYLOXY BENZO-FUSED COMPOUNDS AS HERBICIDES DDT, CNPY2, CBR3 AR 3598/4885CA1 2161/4885CA2 556/4885

“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.