SCHEMBL23300855

SCHEMBL23300855

Cn1nc(-c2cc(C=NOCl)c(Cl)cc2F)c(Cl)c1C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL27536557 0.91 MEN1 (0.32) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL23334073 0.91 MEN1 (0.32) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL8571529 0.86 CYP1A2 (0.35) CYP1A2CYP2C9CYP2C19
SCHEMBL27501073 0.86 MEN1 (0.33) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL8569730 0.84 PKM (0.35) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL8569733 0.84 PKM (0.35) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL7591106 0.82 MEN1 (0.34) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL30130330 0.82 MEN1 (0.34) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL27508912 0.82 MEN1 (0.34) MEN1CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL23334072 0.82 GAA (0.33) CYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112745269-B Phenyl isoxazoline compound and application thereof 沈阳中化农药化工研发有限公司 2023-01-24 CN disclosed
WO-2021082901-A1 PHENYLISOXAZOLINE COMPOUND AND USE THEREOF 沈阳中化农药化工研发有限公司 2021-05-06 WO disclosed
CN-112745269-A Phenyl isoxazoline compound and application thereof 沈阳中化农药化工研发有限公司 2021-05-04 CN disclosed