SCHEMBL22462328

SCHEMBL22462328

CC1Oc2c(C(=O)O)ccc(C(F)(F)F)c2S1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.35
TAS2R14 Q9NYV8 3/20 0.33
ALOX5 P09917 1/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
NOTUM Q6P988 2/20 0.33
KDM4E B2RXH2 2/20 0.33
HSD17B10 Q99714 2/20 0.33
SORT1 Q99523 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
USP2 O75604 1/20 0.32
CYP2C19 P33261 1/20 0.32
ASPH Q12797 1/20 0.32
CES2 O00748 2/20 0.31
CLCN2 P51788 1/20 0.31
CFTR P13569 1/20 0.31
GRIK1 P39086 1/20 0.30
AKR1C3 P42330 1/20 0.30
AKR1C2 P52895 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
SCHEMBL22544467 0.74 POLB (0.44) ALDH1A1HPGDCYP2C19
SCHEMBL21585752 0.71 DAO (0.37) DAOTAS2R14ALDH1A1HPGDNOTUM
SCHEMBL22462326 0.69 KDM4E (0.40) DAOTAS2R14ALDH1A1HPGDNOTUM
SCHEMBL22831405 0.67 KMT2A (0.38) DAOALDH1A1HPGDKDM4EHSD17B10
SCHEMBL31440667 0.66 DAO (0.41) DAOTAS2R14ALDH1A1HPGDNOTUM
SCHEMBL22462329 0.66 DAO (0.41) DAOTAS2R14ALDH1A1HPGDNOTUM
SCHEMBL10053348 0.64 TAS2R14 (0.51) DAOTAS2R14ALDH1A1HPGDNOTUM
SCHEMBL9700677 0.62 SELL (0.54) DAOTAS2R14ALDH1A1HPGDNOTUM
SCHEMBL4647359 0.62 ALDH1A1 (0.43) DAOTAS2R14ALDH1A1HPGDNOTUM
SCHEMBL1458482 0.62 KDM4E (0.43) DAOTAS2R14ALDH1A1HPGDNOTUM

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
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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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 90/4885TAS2R14 2442/4885ALOX5 2558/4885
US-20200325159-A1 HERBICIDALLY ACTIVE BICYCLIC BENZAMIDES CBR3, CBR1, AOX1 DAO 90/4885TAS2R14 2442/4885ALOX5 2558/4885
US-20240116956-A1 HERBICIDALLY ACTIVE BICYCLIC BENZAMIDES CBR3, CBR1, AOX1 DAO 90/4885TAS2R14 2442/4885ALOX5 2558/4885

“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.