SCHEMBL24986989

SCHEMBL24986989

COC(=O)c1nc(-c2ccc(Cl)c(C(F)F)c2Cl)ccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 2/20 0.41
KDM4E B2RXH2 2/20 0.35
PKM P14618 1/20 0.35
RCE1 Q9Y256 1/20 0.35
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PDCD1LG2 Q9BQ51 8/20 0.33
CD274 Q9NZQ7 8/20 0.33
MAPT P10636 2/20 0.33
NPC1 O15118 1/20 0.33
NFKB1 P19838 1/20 0.33
RAB9A P51151 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 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
SCHEMBL30185316 1.00 ALPL (0.41) ALPLKDM4EPKMRCE1ALDH1A1
SCHEMBL24986657 0.91 ALPL (0.41) ALPLKDM4EPKMRCE1ALDH1A1
SCHEMBL24986651 0.89 ALPL (0.36) ALPLKDM4EPKMRCE1ALDH1A1
SCHEMBL3327448 0.84 ALPL (0.40) ALPLKDM4EPKMRCE1ALDH1A1
SCHEMBL24985509 0.83 ALPL (0.44) ALPLKDM4EPKMRCE1ALDH1A1
SCHEMBL3330604 0.82 ALDH1A1 (0.43) ALPLKDM4EPKMRCE1ALDH1A1
SCHEMBL24987916 0.81 KMT2A (0.35) ALPLKDM4EPKMRCE1ALDH1A1
SCHEMBL24987868 0.81 ALPL (0.45) ALPLKDM4EPKMRCE1ALDH1A1
SCHEMBL24985050 0.81 ALPL (0.41) ALPLKDM4EPKMRCE1CYP1A2
SCHEMBL24987944 0.80 ALPL (0.33) ALPLKDM4EPKMRCE1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230017045-A1 PYRIDINE AND PYRIMIDINE CARBOXYLATE HERBICIDES AND METHODS OF USE THEREOF DOW AGROSCIENCES LLC (US) 2023-01-19 US 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-20230017045-A1 PYRIDINE AND PYRIMIDINE CARBOXYLATE HERBICIDES AND METHODS OF USE THEREOF PDXK, DPYD, DDT ALPL 2550/4885KDM4E 1143/4885PKM 1121/4885

“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.