SCHEMBL28512248

SCHEMBL28512248

COC(=O)C(=Cc1ccccc1Cl)c1ccc(F)cc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
ALDH1A1 P00352 3/20 0.44
HPGD P15428 2/20 0.44
LMNA P02545 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
NOS2 P35228 1/20 0.44
MAOB P27338 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
HTT P42858 2/20 0.42
GAA P10253 2/20 0.42
ABCG2 Q9UNQ0 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
SCHEMBL7666908 0.88 LMNA (0.54) MAPTALDH1A1HPGDLMNANPSR1
SCHEMBL7666912 0.88 LMNA (0.54) MAPTALDH1A1HPGDLMNANPSR1
SCHEMBL9239140 0.84 ALDH1A1 (0.51) MAPTALDH1A1HPGDLMNANPSR1
SCHEMBL9226532 0.75 LMNA (0.51) MAPTNPC1RAB9AALDH1A1HPGD
SCHEMBL2080588 0.74 GABRA1 (0.44) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL12784706 0.74 GABRA1 (0.44) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL2080589 0.74 GABRA1 (0.44) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL9551013 0.74 MAPT (0.46) MAPTNPC1RAB9AALDH1A1HPGD
SCHEMBL28039171 0.74 MAPT (0.50) MAPTNPC1RAB9AALDH1A1HPGD
SCHEMBL9551010 0.74 MAPT (0.46) MAPTNPC1RAB9AALDH1A1HPGD

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-112409124-B Preparation method and application of epoxiconazole intermediate 江西华士药业有限公司 2023-09-12 CN claimed
CN-112409124-A Preparation method and application of epoxiconazole intermediate 江西华士药业有限公司 2021-02-26 CN claimed
CN-112409124-B Preparation method and application of epoxiconazole intermediate 江西华士药业有限公司 2023-09-12 CN disclosed
CN-112409124-A Preparation method and application of epoxiconazole intermediate 江西华士药业有限公司 2021-02-26 CN disclosed