SCHEMBL31389251

SCHEMBL31389251

COC(=O)c1cc(OC)c2ccccc2n1

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.77
▸ LMNA P02545 2/20 0.54
▸ HPGD P15428 2/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ DHODH Q02127 1/20 0.53
▸ KDM4E B2RXH2 2/20 0.52
▸ P2RY12 Q9H244 6/20 0.52
▸ SLC2A1 P11166 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ HTT P42858 1/20 0.49

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
SCHEMBL2072605 1.00 ALOX15 (0.77) ALOX15LMNAHPGDSMN1; SMN2DHODH
SCHEMBL297225 0.87 ALOX15 (1.00) ALOX15LMNAHPGDSMN1; SMN2DHODH
SCHEMBL10202005 0.86 ALOX15 (0.79) ALOX15LMNAHPGDSMN1; SMN2KDM4E
SCHEMBL31389238 0.85 ALOX15 (0.57) ALOX15LMNASMN1; SMN2KDM4EP2RY12
SCHEMBL13035843 0.85 ALOX15 (0.73) ALOX15LMNAHPGDSMN1; SMN2P2RY12
SCHEMBL27467736 0.84 ALOX15 (0.77) ALOX15LMNAHPGDSMN1; SMN2KDM4E
SCHEMBL13075989 0.84 ALOX15 (0.77) ALOX15LMNAHPGDSMN1; SMN2KDM4E
SCHEMBL4409321 0.84 ALOX15 (0.77) ALOX15LMNAHPGDSMN1; SMN2KDM4E
SCHEMBL6387003 0.84 ALOX15 (0.77) ALOX15LMNAHPGDSMN1; SMN2KDM4E
SCHEMBL12256861 0.84 ALOX15 (0.77) ALOX15LMNAHPGDSMN1; SMN2KDM4E

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
Send feedback