SCHEMBL29194943

SCHEMBL29194943

O=C(Nc1ccnn1-c1cccc(F)c1F)c1ccccc1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 1/20 0.45
▸ KCNK3 O14649 3/20 0.43
▸ KCNK9 Q9NPC2 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ JAK2 O60674 1/20 0.41
▸ JAK1 P23458 1/20 0.41
▸ TYK2 P29597 1/20 0.41
▸ JAK3 P52333 1/20 0.41
▸ PTPRC P08575 1/20 0.41
▸ NTRK1 P04629 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ IDO1 P14902 2/20 0.40
▸ F2R P25116 1/20 0.39

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
SCHEMBL11029149 0.72 JAK2 (0.74) LMNAKDM4EJAK2JAK1TYK2
SCHEMBL30051650 0.72 JAK2 (0.74) LMNAKDM4EJAK2JAK1TYK2
SCHEMBL405944 0.70 JAK2 (0.65) JAK2JAK1TYK2JAK3NTRK1
SCHEMBL17145113 0.68 KCNK3 (0.50) RECQLKCNK3KCNK9LMNAPTGS1
SCHEMBL15639883 0.68 PTGES (0.45) RECQLKCNK3KCNK9LMNAPTGS1
SCHEMBL15639828 0.68 PTGS1 (0.55) RECQLKCNK3KCNK9LMNAPTGS1
SCHEMBL30052299 0.67 JAK2 (0.77) LMNAKDM4EJAK2JAK1TYK2
SCHEMBL11027852 0.67 JAK2 (0.77) LMNAKDM4EJAK2JAK1TYK2
SCHEMBL16372385 0.67 LMNA (0.46) RECQLKCNK3KCNK9LMNAPTGS1
SCHEMBL17111294 0.67 STIM1 (0.51) RECQLKCNK3KCNK9LMNAPTGS1

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
CN-117567338-A Novel heteroaryl triazole compounds as pesticides 拜耳公司 2024-02-20 — — CN disclosed
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