SCHEMBL28492145

SCHEMBL28492145

Fc1ccc(Oc2cc(-c3ccccc3)c3nc(Cl)nc(Cl)c3n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ HTT P42858 1/20 0.38
▸ LOXL2 Q9Y4K0 1/20 0.37
▸ TOP1 P11387 2/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ HPGD P15428 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ MAPT P10636 3/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ SCN9A Q15858 6/20 0.35
▸ BTK Q06187 1/20 0.33
▸ EGLN1 Q9GZT9 1/20 0.33

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
SCHEMBL28495101 0.81 HTT (0.48) MEN1KMT2AL3MBTL1HTTLOXL2
SCHEMBL28498767 0.80 SCN9A (0.39) MEN1KMT2AL3MBTL1TOP1HPGD
SCHEMBL28492187 0.72 TOP1 (0.40) MEN1KMT2AL3MBTL1HTTLOXL2
SCHEMBL28494857 0.70 ADORA2A (0.43) MEN1KMT2AL3MBTL1HTTLOXL2
SCHEMBL18153300 0.69 MEN1 (0.51) MEN1KMT2AL3MBTL1HTTALDH1A1
SCHEMBL24309569 0.68 TDP1 (0.70) MEN1KMT2AL3MBTL1HTTLOXL2
SCHEMBL3410924 0.66 ALDH1A1 (0.61) MEN1KMT2AL3MBTL1HTTMAPK1
SCHEMBL17609003 0.64 ATM (0.59) MEN1KMT2AL3MBTL1HTTLOXL2
SCHEMBL18153341 0.63 ALDH1A1 (0.41) MEN1KMT2AL3MBTL1HTTALDH1A1
SCHEMBL28252052 0.63 MEN1 (0.80) MEN1KMT2AL3MBTL1HTTTOP1

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-112079830-B Inhibitor containing fused ring derivative, preparation method and application thereof 上海翰森生物医药科技有限公司 2023-12-22 — — CN disclosed
CN-112079830-A Fused ring-containing derivative inhibitor, preparation method and application thereof 上海翰森生物医药科技有限公司 2020-12-15 — — CN disclosed
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