SCHEMBL24986973

SCHEMBL24986973

COC(=O)c1nc(-c2cc(F)c(OC)cc2F)ccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 4/20 0.40
GRM4 Q14833 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.37
PKM P14618 1/20 0.37
RCE1 Q9Y256 1/20 0.37
AAK1 Q2M2I8 1/20 0.37
NOTUM Q6P988 1/20 0.36
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
KCNH2 Q12809 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 1/20 0.36
S1PR4 O95977 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
PDCD1LG2 Q9BQ51 1/20 0.35

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
SCHEMBL24987942 0.84 CTSA (0.43) ALPLALDH1A1KDM4EPKMRCE1
SCHEMBL24986565 0.84 ALDH1A1 (0.39) ALPLALDH1A1KDM4EPKMRCE1
SCHEMBL24985476 0.83 ALPL (0.57) ALPLALDH1A1KDM4EPKMRCE1
SCHEMBL30185096 0.83 NOTUM (0.41) ALPLALDH1A1KDM4EPKMRCE1
SCHEMBL24985197 0.83 NOTUM (0.41) ALPLALDH1A1KDM4EPKMRCE1
SCHEMBL24986991 0.82 MAPT (0.43) GRM4ALDH1A1KDM4EPKMRCE1
SCHEMBL24986683 0.82 MAPT (0.41) ALPLNOTUMHTR2ALMNAGAA
SCHEMBL30185256 0.82 MAPT (0.41) ALPLNOTUMHTR2ALMNAGAA
SCHEMBL24986936 0.82 KMO (0.49) ALPLALDH1A1PKMS1PR4SMN1; SMN2
SCHEMBL24985716 0.82 ALPL (0.54) ALPLALDH1A1KDM4EPKMRCE1

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 2550/4885GRM4 583/4885ALDH1A1 123/4885

“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.