SCHEMBL25106936

SCHEMBL25106936

CCS(=O)(=O)c1c(-c2nc3cc(C(F)(F)F)cnc3n2C)ncc2cc(Cl)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.41
▸ DDR1 Q08345 11/20 0.36
▸ LMNA P02545 3/20 0.36
▸ HTT P42858 3/20 0.36
▸ NPSR1 Q6W5P4 3/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ XBP1 P17861 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ NCOA2 Q15596 1/20 0.36
▸ NCOA1 Q15788 1/20 0.36
▸ NCOA3 Q9Y6Q9 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ NLRP3 Q96P20 1/20 0.33
▸ PKM P14618 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
SCHEMBL18819868 0.92 POLB (0.43) POLBDDR1
SCHEMBL25106704 0.91 POLB (0.42) POLBDDR1LMNAHTTNPSR1
SCHEMBL25106702 0.90 POLB (0.41) POLBLMNAHTTNPSR1ALDH1A1
SCHEMBL25106687 0.89 POLB (0.41) POLBDDR1HTTSMN1; SMN2ALDH1A1
SCHEMBL18819841 0.88 POLB (0.43) POLBDDR1LMNAHTTALDH1A1
SCHEMBL25106719 0.87 POLB (0.42) POLBDDR1LMNANPSR1SMN1; SMN2
SCHEMBL25106700 0.86 POLB (0.39) POLBDDR1SMN1; SMN2ALDH1A1CYP1A2
SCHEMBL25106930 0.86 POLB (0.41) POLBLMNAALDH1A1CYP2C9CYP2C19
SCHEMBL25106715 0.86 DDR1 (0.33) DDR1LMNA
SCHEMBL25106953 0.86 POLB (0.42) POLBLMNAHTTNPSR1ALDH1A1

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-20230060425-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2023-03-02 — — 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-20230060425-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, CBR1, CBR3 POLB 3767/4885DDR1 3261/4885LMNA 1965/4885

“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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