SCHEMBL30185249

SCHEMBL30185249

COC(=O)c1nc(-c2ccc(C(F)(F)F)cc2C(F)(F)F)ccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ EIF4E P06730 2/20 0.43
▸ TRPV3 Q8NET8 3/20 0.43
▸ AGPAT2 O15120 2/20 0.42
▸ NOTUM Q6P988 3/20 0.41
▸ MCL1 Q07820 1/20 0.41
▸ CFTR P13569 1/20 0.41
▸ CES2 O00748 1/20 0.40
▸ CYP1A2 P05177 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ MRGPRX4 Q96LA9 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ NPSR1 Q6W5P4 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
SCHEMBL24985042 1.00 EIF4E (0.43) EIF4ETRPV3AGPAT2NOTUMMCL1
SCHEMBL30185174 0.90 NPSR1 (0.45) EIF4EAGPAT2MCL1CFTRCYP1A2
SCHEMBL22366910 0.90 NPSR1 (0.45) EIF4EAGPAT2MCL1CFTRCYP1A2
SCHEMBL24985471 0.89 MCL1 (0.44) AGPAT2MCL1CFTRCYP1A2CYP3A4
SCHEMBL24986498 0.89 AGPAT2 (0.47) EIF4EAGPAT2MCL1CFTRCYP1A2
SCHEMBL24984999 0.88 MPL (0.42) AGPAT2MCL1CFTRCYP1A2CYP3A4
SCHEMBL30185292 0.87 AGPAT2 (0.41) AGPAT2NOTUMMCL1CFTRCYP1A2
SCHEMBL24985500 0.87 MAPT (0.47) AGPAT2CFTRCYP1A2CYP3A4CYP2C19
SCHEMBL24986504 0.87 AGPAT2 (0.41) AGPAT2NOTUMMCL1CFTRCYP1A2
SCHEMBL24985309 0.87 NPSR1 (0.44) EIF4EAGPAT2NOTUMMCL1CFTR

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 EIF4E 3624/4885TRPV3 3090/4885AGPAT2 1664/4885

“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.

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