SCHEMBL2733461

SCHEMBL2733461

NC(=O)c1cn(CI)nc1C(F)F

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 2/20 0.36
▸ PARP1 P09874 2/20 0.33
▸ PARP2 Q9UGN5 1/20 0.33
▸ PARP3 Q9Y6F1 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
SCHEMBL26134016 0.87 KLKB1 (0.36) KLKB1PARP1PARP2PARP3
SCHEMBL26133925 0.85 L3MBTL1 (0.40) KLKB1PARP1PARP2PARP3
SCHEMBL1275235 0.85 KLKB1 (0.37) KLKB1
SCHEMBL26135704 0.80 ADORA3 (0.36) KLKB1PARP1PARP2PARP3
SCHEMBL26135903 0.80 ADORA3 (0.36) KLKB1PARP1PARP2PARP3
SCHEMBL345169 0.79 ADORA2A (0.37) KLKB1PARP1PARP2PARP3
Hydrochloric Acid SCHEMBL31096988 0.78 ADORA2A (0.36) KLKB1PARP1PARP2PARP3
SCHEMBL1276282 0.77 TSHR (0.40) KLKB1
Thiourea SCHEMBL28847920 0.75 GAA (0.36) KLKB1PARP1PARP2PARP3
SCHEMBL28214209 0.74 ADRA1D (0.48) KLKB1PARP1PARP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2445347-A2 Method for enhancing harvest security of crops requiring vernalization BASF SE (DE) 2012-05-02 — — EP claimed
WO-2010149504-A2 METHOD FOR ENHANCING HARVEST SECURITY OF CROPS REQUIRING VERNALIZATION BASF SE (DE) 2010-12-29 — — WO claimed
EP-2091330-A2 PESTICIDAL MIXTURES COMPRISING AN ANTHRANILAMIDE INSECTICIDE AND A FUNGICIDE BASF SE (DE) 2009-08-26 — — EP claimed
WO-2008034785-A2 PESTICIDAL MIXTURES COMPRISING AN ANTHRANILAMIDE INSECTICIDE AND A FUNGICIDE BASF SE (DE) 2008-03-27 — — WO claimed
WO-2010029067-A2 METHOD FOR INCREASING THE NUMBER OF SEEDLINGS PER NUMBER OF SOWED GRAINS OF SEED BASF SE (DE) 2010-03-18 — — WO disclosed
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