SCHEMBL21585752

SCHEMBL21585752

O=C(O)c1ccc(C(F)(F)F)c2c1OCS2

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.37
ALDH1A1 P00352 3/20 0.34
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ASPH Q12797 1/20 0.33
FABP4 P15090 3/20 0.33
CES2 O00748 2/20 0.33
CLCN2 P51788 1/20 0.32
CFTR P13569 1/20 0.32
NOTUM Q6P988 1/20 0.32
GRIK1 P39086 1/20 0.32
TAS2R14 Q9NYV8 2/20 0.31
FABP3 P05413 1/20 0.31
NFKB1 P19838 1/20 0.31

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
SCHEMBL22831405 0.83 KMT2A (0.38) DAOALDH1A1HPGDKDM4EHSD17B10
SCHEMBL22462329 0.74 DAO (0.41) DAOALDH1A1HPGDKDM4EHSD17B10
SCHEMBL31440667 0.74 DAO (0.41) DAOALDH1A1HPGDKDM4EHSD17B10
SCHEMBL22544605 0.73 POLB (0.46) ALDH1A1HPGD
SCHEMBL21587844 0.72 RAB9A (0.30)
SCHEMBL21585751 0.71 PTGDR2 (0.30)
SCHEMBL22462328 0.71 DAO (0.35) DAOALDH1A1HPGDKDM4EHSD17B10
SCHEMBL8307809 0.70 SMN1; SMN2 (0.36) ALDH1A1KDM4EHSD17B10
SCHEMBL22749580 0.69 ALDH1A1 (0.36) DAOALDH1A1HPGDKDM4EHSD17B10
SCHEMBL19519485 0.66 ALDH1A1 (0.40) ALDH1A1HPGDKDM4EHSD17B10KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240116956-A1 HERBICIDALLY ACTIVE BICYCLIC BENZAMIDES BAYER AKTIENGESELLSCHAFT (DE) 2024-04-11 US disclosed
US-11897904-B2 Herbicidally active bicyclic benzamides BAYER AKTIENGESELLSCHAFT (DE) 2024-02-13 US disclosed
EP-3713417-B1 HERBICIDALLY ACTIVE BICYCLIC BENZAMIDES BAYER AG (DE) 2024-01-17 EP disclosed
US-20210323950-A1 HERBICIDALLY ACTIVE BICYCLIC BENZOYLPYRAZOLES BAYER AG (DE) 2021-10-21 US disclosed
EP-3802521-A1 HERBICIDALLY ACTIVE BICYCLIC BENZOYLPYRAZOLES Bayer Aktiengesellschaft (DE) 2021-04-14 EP disclosed
CN-112513033-A Herbicidally active bicyclic benzoylpyrazoles 拜耳公司 2021-03-16 CN disclosed
US-20200325159-A1 HERBICIDALLY ACTIVE BICYCLIC BENZAMIDES BAYER AKTIENGESELLSCHAFT (DE) 2020-10-15 US disclosed
EP-3713417-A1 HERBICIDALLY ACTIVE BICYCLIC BENZAMIDES Bayer Aktiengesellschaft (DE) 2020-09-30 EP disclosed
CN-111356368-A Herbicidally active bicyclic benzamides 拜耳公司 2020-06-30 CN disclosed
WO-2019233863-A1 HERBICIDALLY ACTIVE BICYCLIC BENZOYLPYRAZOLES BAYER AKTIENGESELLSCHAFT (DE) 2019-12-12 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 (4 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-11897904-B2 Herbicidally active bicyclic benzamides CBR3, CBR1, AOX1 DAO 90/4885ALDH1A1 756/4885HPGD 1541/4885
US-20200325159-A1 HERBICIDALLY ACTIVE BICYCLIC BENZAMIDES CBR3, CBR1, AOX1 DAO 90/4885ALDH1A1 756/4885HPGD 1541/4885
US-20210323950-A1 HERBICIDALLY ACTIVE BICYCLIC BENZOYLPYRAZOLES CBR3, CBR1, RTN3 DAO 546/4885ALDH1A1 338/4885HPGD 1330/4885
US-20240116956-A1 HERBICIDALLY ACTIVE BICYCLIC BENZAMIDES CBR3, CBR1, AOX1 DAO 90/4885ALDH1A1 756/4885HPGD 1541/4885

“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.