SCHEMBL30173408

SCHEMBL30173408

CC1(C)CCc2c(NC(=O)c3cccnc3C(F)F)cccc21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ KDR P35968 2/20 0.37
▸ TNKS O95271 1/20 0.37
▸ TNKS2 Q9H2K2 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ L3MBTL1 Q9Y468 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ PABPC1 P11940 2/20 0.35
▸ EIF4H Q15056 2/20 0.35
▸ KIF18A Q8NI77 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HTT P42858 1/20 0.35

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
SCHEMBL20440050 1.00 KDM4E (0.41) KDM4EALDH1A1KDRTNKSTNKS2
SCHEMBL21728264 0.87 P2RY1 (0.30) —
SCHEMBL9651972 0.84 KDM4E (0.52) KDM4EALDH1A1KDRSMN1; SMN2MAPT
SCHEMBL15826550 0.82 L3MBTL1 (0.42) KDM4EALDH1A1KDRSMN1; SMN2MAPT
SCHEMBL16425212 0.81 ATM (0.42) —
SCHEMBL28459124 0.81 ALDH1A1 (0.42) KDM4EALDH1A1KDRTNKSTNKS2
SCHEMBL18905248 0.79 KDM4E (0.39) KDM4EALDH1A1KDRSMN1; SMN2MAPT
SCHEMBL29372054 0.79 ALDH1A1 (0.45) KDM4EALDH1A1KDRSMN1; SMN2MAPT
SCHEMBL21359712 0.79 ALDH1A1 (0.45) KDM4EALDH1A1KDRSMN1; SMN2MAPT
SCHEMBL29351971 0.79 ALDH1A1 (0.45) KDM4EALDH1A1KDRSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115836049-A Use of strobilurin-type compounds to control phytopathogenic fungi containing the amino acid substitution F129L in the mitochondrial cytochrome b protein conferring tolerance to Qo inhibitor VI 巴斯夫欧洲公司 2023-03-21 — — CN disclosed
CN-115803314-A Strobilurin-type compounds and their use for combating phytopathogenic fungi 巴斯夫欧洲公司 2023-03-14 — — CN disclosed
CN-115702139-A Use of strobilurin-type compounds to control phytopathogenic fungi containing the amino acid substitution F129L in the mitochondrial cytochrome b protein conferring tolerance to Qo inhibitor V 巴斯夫欧洲公司 2023-02-14 — — CN disclosed
CN-115697056-A Fungicidal compositions 先正达农作物保护股份公司 2023-02-03 — — CN disclosed
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