SCHEMBL24985335

SCHEMBL24985335

CSc1cc(C(F)(F)F)cc(Cl)c1C(C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 2/20 0.41
GABRB3 P28472 16/20 0.40
GABRA2 P47869 15/20 0.40
GABRB2 P47870 15/20 0.40
GABRP O00591 13/20 0.40
GABRD O14764 13/20 0.40
GABRA1 P14867 13/20 0.40
GABRB1 P18505 13/20 0.40
GABRG2 P18507 13/20 0.40
GABRA5 P31644 13/20 0.40
GABRA3 P34903 13/20 0.40
GABRA4 P48169 13/20 0.40
GABRE P78334 13/20 0.40
GABRA6 Q16445 13/20 0.40
GABRG1 Q8N1C3 13/20 0.40
GABRG3 Q99928 13/20 0.40
GABRQ Q9UN88 13/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
RAB9A P51151 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
SCHEMBL8737614 0.82 PDE2A (0.50) PDE2AGABRB3GABRA2GABRB2GABRP
SCHEMBL22366922 0.80 GABRB3 (0.48) PDE2AGABRB3GABRA2GABRB2GABRP
SCHEMBL15958518 0.76 PDE2A (0.44) PDE2AGABRB3GABRA2GABRB2GABRP
SCHEMBL21139491 0.76 PDE2A (0.44) PDE2AGABRB3GABRA2GABRB2GABRP
SCHEMBL24986405 0.74 PDE2A (0.43) PDE2AGABRB3GABRA2GABRB2GABRP
SCHEMBL24986404 0.74 PDE2A (0.43) PDE2AGABRB3GABRA2GABRB2GABRP
SCHEMBL24986389 0.71 PDE2A (0.41) PDE2AGABRB3GABRA2GABRB2GABRP
SCHEMBL8561738 0.71 PDE2A (0.61) PDE2AGABRA2GABRB2SMN1; SMN2
SCHEMBL13748819 0.70 AR (0.47) PDE2AGABRB3GABRA2GABRB2GABRP
SCHEMBL12009464 0.69 PDE2A (0.46) PDE2ARAB9A

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 PDE2A 2216/4885GABRB3 383/4885GABRA2 576/4885

“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.