SCHEMBL24986936

SCHEMBL24986936

COC(=O)c1nc(-c2ccc(Cl)cc2F)ccc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.49
ALPL P05186 4/20 0.45
ALDH1A1 P00352 1/20 0.42
S1PR4 O95977 1/20 0.42
PTGES O14684 1/20 0.41
PKM P14618 1/20 0.40
CNR1 P21554 1/20 0.39
EIF4E P06730 1/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
NFKB1 P19838 1/20 0.39
RAB9A P51151 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SLC6A3 Q01959 1/20 0.39
CYP1B1 Q16678 1/20 0.39
PLA2G2A P14555 1/20 0.39
ABL1 P00519 1/20 0.38

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
SCHEMBL24985716 0.90 ALPL (0.54) KMOALPLALDH1A1PTGESPKM
SCHEMBL24984506 0.88 ALPL (0.58) ALPLS1PR4PKMCNR1NPC1
SCHEMBL24984999 0.85 MPL (0.42) ALPLMAPT
SCHEMBL24986565 0.83 ALDH1A1 (0.39) ALPLALDH1A1S1PR4PKMMAPT
SCHEMBL24987942 0.83 CTSA (0.43) ALPLALDH1A1S1PR4PKMNPC1
SCHEMBL24985064 0.83 ALDH1A1 (0.43) ALPLALDH1A1S1PR4PKMNPC1
SCHEMBL24985476 0.83 ALPL (0.57) ALPLALDH1A1PKMNPC1MAPT
SCHEMBL24987818 0.83 SCN9A (0.44) ALPLALDH1A1PKMEIF4ENPC1
SCHEMBL24985011 0.82 ALPL (0.39) KMOALPLALDH1A1S1PR4PKM
SCHEMBL24985509 0.81 ALPL (0.44) ALPLALDH1A1PKMNPC1MAPT

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 KMO 500/4885ALPL 2550/4885ALDH1A1 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.