SCHEMBL17064211

SCHEMBL17064211

O=C(Nc1ncn(-c2c(F)cccc2F)n1)c1ccccc1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ KCNK3 O14649 3/20 0.44
▸ KCNK9 Q9NPC2 3/20 0.44
▸ PTGS1 P23219 1/20 0.44
▸ PTGES O14684 5/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ F2R P25116 1/20 0.41
▸ PTPRC P08575 1/20 0.40

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
SCHEMBL17064212 0.92 SMN1; SMN2 (0.46) LMNAGAAKCNK3KCNK9PTGS1
SCHEMBL17064204 0.88 RXFP1 (0.40) LMNAGAAKCNK3KCNK9PTGS1
SCHEMBL17064201 0.85 KCNK3 (0.44) LMNAKCNK3KCNK9PTGESKMT2A
SCHEMBL17064208 0.83 KDR (0.45) KMT2A
SCHEMBL17064210 0.81 PTGES (0.41) LMNAGAAKCNK3KCNK9PTGS1
SCHEMBL17073933 0.81 KMT2A (0.44) LMNAGAAKMT2ATP53RXFP1
SCHEMBL17073927 0.80 MEN1 (0.44) LMNAKCNK3KCNK9KMT2ARXFP1
SCHEMBL17111294 0.80 STIM1 (0.51) LMNAGAAKCNK3KCNK9PTGS1
SCHEMBL17145113 0.77 KCNK3 (0.50) LMNAGAAKCNK3KCNK9PTGS1
SCHEMBL17064215 0.75 SMN1; SMN2 (0.43) LMNAKMT2ATP53RXFP1F2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3113618-B1 HETEROCYCLIC COMPOUNDS AS PEST CONTROLLERS BAYER CROPSCIENCE AG (DE) 2018-07-04 — — EP disclosed
US-9920017-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-03-20 — — US disclosed
US-9920017-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-03-20 — — US disclosed
US-9920017-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-03-20 — — US disclosed
US-20170073318-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-03-16 — — US disclosed
US-20170073318-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-03-16 — — US disclosed
US-20170073318-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-03-16 — — US disclosed
EP-3113618-A1 HETEROCYCLIC COMPOUNDS AS PEST CONTROL AGENTS Bayer CropScience Aktiengesellschaft (DE) 2017-01-11 — — EP disclosed
WO-2015132313-A1 HETEROCYCLIC COMPOUNDS AS PEST CONTROL AGENTS BAYER CROPSCIENCE AG (DE) 2015-09-11 — — WO disclosed
WO-2015132313-A1 HETEROCYCLIC COMPOUNDS AS PEST CONTROL AGENTS BAYER CROPSCIENCE AG (DE) 2015-09-11 — — 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-20170073318-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES DDT, ACHE, PTMS LMNA 1992/4885GAA 2156/4885KCNK3 2036/4885

“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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