SCHEMBL17145113

SCHEMBL17145113

O=C(Nc1cnn(-c2c(F)cccc2F)c1)c1ccccc1C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 3/20 0.50
▸ KCNK9 Q9NPC2 3/20 0.50
▸ PTGS1 P23219 1/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.46
▸ F2R P25116 1/20 0.46
▸ PTGES O14684 4/20 0.45
▸ LMNA P02545 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ PTPRC P08575 1/20 0.45
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ IDO1 P14902 1/20 0.42
▸ ABL1 P00519 1/20 0.42
▸ SRC P12931 1/20 0.42
▸ P2RX1 P51575 1/20 0.42
▸ P2RX7 Q99572 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ RECQL P46063 1/20 0.41
▸ HTT P42858 1/20 0.41

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
SCHEMBL19588952 0.92 KCNK3 (0.46) KCNK3KCNK9PTGS1RXFP1F2R
SCHEMBL17144855 0.90 KCNK3 (0.43) KCNK3KCNK9PTGS1RXFP1F2R
SCHEMBL15639828 0.79 PTGS1 (0.55) KCNK3KCNK9PTGS1RXFP1F2R
SCHEMBL17111294 0.78 STIM1 (0.51) KCNK3KCNK9PTGS1RXFP1F2R
SCHEMBL17064211 0.77 LMNA (0.45) KCNK3KCNK9PTGS1RXFP1F2R
SCHEMBL15639883 0.77 PTGES (0.45) KCNK3KCNK9PTGS1RXFP1F2R
SCHEMBL5332281 0.72 KCNK3 (0.75) KCNK3KCNK9PTGS1RXFP1F2R
SCHEMBL21022150 0.71 LMNA (0.66) KCNK3KCNK9PTGS1RXFP1F2R
SCHEMBL17064212 0.70 SMN1; SMN2 (0.46) KCNK3KCNK9PTGS1RXFP1F2R
SCHEMBL26938134 0.70 SMN1; SMN2 (0.46) LMNAGAAMEN1KMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3126335-B1 N-(1-(HETERO)ARYL-1H-PYRAZOL-4-YL)-(HETERO)ARYLAMIDE DERIVATIVES AND THEIR USE AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2020-07-08 — — EP disclosed
US-9815792-B2 Method for producing carboxamides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-11-14 — — US disclosed
US-9815792-B2 Method for producing carboxamides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-11-14 — — US disclosed
US-9815792-B2 Method for producing carboxamides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-11-14 — — US disclosed
EP-3126335-A1 N-(1-(HETERO)ARYL-1H-PYRAZOL-4-YL)-(HETERO)ARYLAMIDE DERIVATIVES AND USE THEREOF AS PESTICIDES Bayer CropScience Aktiengesellschaft (DE) 2017-02-08 — — EP disclosed
US-20170022168-A1 METHOD FOR PRODUCING CARBOXAMIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-01-26 — — US disclosed
US-20170022168-A1 METHOD FOR PRODUCING CARBOXAMIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-01-26 — — US disclosed
WO-2015150300-A1 N-(1-(HETERO)ARYL-1H-PYRAZOL-4-YL)-(HETERO)ARYLAMIDE DERIVATIVES AND USE THEREOF AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2015-10-08 — — WO disclosed
WO-2015150300-A1 N-(1-(HETERO)ARYL-1H-PYRAZOL-4-YL)-(HETERO)ARYLAMIDE DERIVATIVES AND USE THEREOF AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2015-10-08 — — WO 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-20170022168-A1 METHOD FOR PRODUCING CARBOXAMIDES AADAC, CPS1, NAAA KCNK3 3372/4885KCNK9 3539/4885PTGS1 1971/4885

“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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