SCHEMBL28623768

SCHEMBL28623768

FC(F)OC[C@@H]1CN(Cc2ccc(OC(F)F)cc2)CCN1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.56
PDE2A O00408 1/20 0.39
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
JAK3 P52333 1/20 0.37
MLNR O43193 5/20 0.37
POLB P06746 1/20 0.36
TACR1 P25103 2/20 0.34
DRD4 P21917 2/20 0.34
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL28623770 1.00 LTA4H (0.56) LTA4HPDE2AJAK2JAK1JAK3
SCHEMBL28619739 0.84 LTA4H (0.49) LTA4HMLNRTACR1DRD4
SCHEMBL28619738 0.84 LTA4H (0.49) LTA4HMLNRTACR1DRD4
SCHEMBL8123690 0.77 LTA4H (0.52) LTA4HPOLB
SCHEMBL31535374 0.73 LTA4H (0.62) LTA4HTACR1DRD4
SCHEMBL28609586 0.73 TP53 (0.39) LTA4HJAK2JAK1JAK3MLNR
SCHEMBL28609587 0.73 TP53 (0.39) LTA4HJAK2JAK1JAK3MLNR
SCHEMBL28612840 0.72 POLB (0.39) POLB
SCHEMBL28612839 0.72 POLB (0.39) POLB
SCHEMBL28622416 0.72 LTA4H (0.33) LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113072546-B Five-membered heteroaromatic derivative and preparation method and application thereof 广东东阳光药业股份有限公司 2025-05-30 CN disclosed
CN-113072546-A Five-membered heteroaromatic derivative and preparation method and application thereof 广东东阳光药业有限公司 2021-07-06 CN disclosed