SCHEMBL28229807

SCHEMBL28229807

O=CC1NC=NN1c1ccccc1F

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 1/20 0.39
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ ALDH1A1 P00352 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ HCAR1 Q9BXC0 5/20 0.33
▸ KCNN4 O15554 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ NOTUM Q6P988 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31

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
SCHEMBL27640352 0.81 MGLL (0.39) MGLLALDH1A1TDP1HCAR1KDM4E
SCHEMBL27640364 0.81 MAPT (0.38) MEN1KMT2AALDH1A1TDP1HCAR1
SCHEMBL27418186 0.77 ALDH1A1 (0.33) MGLLMEN1KMT2AALDH1A1MAPT
SCHEMBL27447642 0.75 MEN1 (0.35) MGLLMEN1KMT2AALDH1A1HPGD
SCHEMBL27621423 0.74 MGLL (0.35) MGLLHPGD
SCHEMBL27640321 0.73 FAAH (0.41) MGLLMEN1KMT2AALDH1A1POLB
SCHEMBL27448230 0.68 MGLL (0.35) MGLLMEN1KMT2AALDH1A1HPGD
SCHEMBL27640373 0.68 TDP1 (0.36) TDP1NOTUM
SCHEMBL27640347 0.68 MGLL (0.40) MGLLALDH1A1HCAR1KDM4ENOTUM
SCHEMBL28770717 0.65 KDM4E (0.35) MEN1KMT2AALDH1A1TDP1KDM4E

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-108290886-A 2- (hetero) aryl-substituted fused bicyclic heterocyclic derivatives as pest control agents 拜耳作物科学股份公司 2018-07-17 — — CN disclosed
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