SCHEMBL13058569

SCHEMBL13058569

CCc1sc(-c2ccc(Br)cc2C)nc1C1=C(OC(=O)c2ccc(Cl)cc2)[C@@H]2[C@H](C1=O)[C@H]1CC[C@@H]2O1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ PTGDR2 Q9Y5Y4 1/20 0.34
▸ GLA P06280 3/20 0.33
▸ MAPT P10636 4/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ POLB P06746 1/20 0.30
▸ ACHE P22303 1/20 0.30

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
SCHEMBL13058559 0.77 PTGDR2 (0.38) MEN1KMT2AKDM4EALDH1A1PTGDR2
SCHEMBL3254228 0.77 PTGDR2 (0.38) MEN1KMT2AKDM4EALDH1A1PTGDR2
SCHEMBL13058564 0.77 PTGDR2 (0.38) MEN1KMT2AKDM4EALDH1A1PTGDR2
SCHEMBL13058568 0.76 — —
SCHEMBL13058563 0.76 PTGDR2 (0.37) MEN1KMT2AKDM4EALDH1A1PTGDR2
SCHEMBL13058433 0.71 GLA (0.37) GLALMNA
SCHEMBL6727699 0.64 ACACB (0.42) KMT2ALMNA
SCHEMBL13058566 0.64 ADAMTS5 (0.30) —
SCHEMBL13058571 0.63 CRHR1 (0.31) —
SCHEMBL13058522 0.63 POLB (0.31) POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2188294-B1 TRICYCLIC BRIDGED CYCLOPENTANEDIONE DERIVATIVES AS HERBICIDES SYNGENTA LTD (GB) 2015-03-18 — — EP disclosed
US-8530667-B2 Herbicides SYNGENTA LIMITED (GB) 2013-09-10 — — US disclosed
US-8530667-B2 Herbicides SYNGENTA LIMITED (GB) 2013-09-10 — — US disclosed
US-20100298140-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-11-25 — — US disclosed
US-20100298140-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-11-25 — — US disclosed
WO-2009030450-A2 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2009-03-12 — — 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-20100298140-A1 NOVEL HERBICIDES DDT, CYP1B1, CYP1A1 MEN1 4244/4885KMT2A 726/4885KDM4E 1070/4885

“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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