SCHEMBL17991472

SCHEMBL17991472

O=C(NCC(F)(F)c1ncc(-c2cc(F)cc(F)c2)cc1Cl)c1ccccc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 6/20 0.41
▸ LMNA P02545 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ PTGES O14684 8/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL16552192 0.92 P2RX7 (0.39) P2RX7LMNATP53GAAPTGES
SCHEMBL16665036 0.92 TP53 (0.45) P2RX7LMNATP53GAA
SCHEMBL16665062 0.91 P2RX7 (0.40) P2RX7LMNAGAAPTGESKDM4E
SCHEMBL16665046 0.91 LMNA (0.41) P2RX7LMNAGAAPTGESKDM4E
SCHEMBL16552224 0.90 LMNA (0.39) P2RX7LMNATP53GAAPTGES
SCHEMBL17917768 0.89 P2RX7 (0.39) P2RX7LMNATP53GAAPTGES
SCHEMBL16552201 0.89 LMNA (0.38) P2RX7LMNATP53GAAPTGES
SCHEMBL16654673 0.89 P2RX7 (0.44) P2RX7LMNAGAAKDM4E
SCHEMBL16665050 0.88 GRIN2B (0.43) P2RX7TP53
SCHEMBL16665063 0.88 P2RX7 (0.38) P2RX7LMNATP53GAAKDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9776967-B2 Carboxamide derivatives as pesticidal compounds BAYER ANIMAL HEALTH GMBH (DE) 2017-10-03 — — US disclosed
US-9776967-B2 Carboxamide derivatives as pesticidal compounds BAYER ANIMAL HEALTH GMBH (DE) 2017-10-03 — — US disclosed
US-20160221950-A1 CARBOXAMIDE DERIVATIVES AS PESTICIDAL COMPOUNDS ELANCO ANIMAL HEALTH GMBH (DE) 2016-08-04 — — US disclosed
US-20160221950-A1 CARBOXAMIDE DERIVATIVES AS PESTICIDAL COMPOUNDS ELANCO ANIMAL HEALTH GMBH (DE) 2016-08-04 — — 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-20160221950-A1 CARBOXAMIDE DERIVATIVES AS PESTICIDAL COMPOUNDS ACHE, DDT, NIT2 P2RX7 323/4885LMNA 2273/4885TP53 4879/4885

“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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