SCHEMBL31389269

SCHEMBL31389269

COC(=O)c1cc(OCc2cccc3ccccc23)c2ccccc2n1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.50
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ FDPS P14324 1/20 0.47
▸ PARP10 Q53GL7 2/20 0.47
▸ PARP15 Q460N3 1/20 0.47
▸ MAPK8 P45983 2/20 0.46
▸ MAPK9 P45984 2/20 0.46
▸ MAPK10 P53779 2/20 0.46
▸ MAPT P10636 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ ATM Q13315 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ FFAR1 O14842 1/20 0.44
▸ AKR1B1 P15121 1/20 0.44

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
SCHEMBL31389276 0.88 ALOX15 (0.58) ALOX15MEN1KMT2AFDPSPARP10
SCHEMBL31389281 0.85 MEN1 (0.61) ALOX15MEN1KMT2AFDPSPARP10
SCHEMBL31389266 0.85 ALOX15 (0.55) ALOX15MAPTTDP1
SCHEMBL31389291 0.84 ALOX15 (0.51) ALOX15KMT2AMAPTTDP1
SCHEMBL31389238 0.82 ALOX15 (0.57) ALOX15
SCHEMBL31389256 0.81 ALOX15 (0.50) ALOX15MAPTTDP1
SCHEMBL31389313 0.81 ALOX15 (0.47) ALOX15PARP15MAPTTDP1GAA
SCHEMBL31389249 0.81 ALOX15 (0.47) ALOX15PARP15MAPTTDP1GAA
SCHEMBL9381350 0.80 ALOX15 (0.55) ALOX15MEN1KMT2AMAPTGAA
SCHEMBL31389289 0.80 MAPT (0.58) ALOX15MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119264047-A Quinoline derivative histone deacetylase inhibitor and preparation method and application thereof 山东大学 2025-01-07 — — CN disclosed
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