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Sugi Predict / Compounds / SCHEMBL24890848

SCHEMBL24890848

SCHEMBL24890848

Nc1ccccc1NC(=O)c1ccc(NC(=O)OCc2ccc(C3C[C@@H]3N)cc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 18/20 0.77
▸ RCOR1 Q9UKL0 15/20 0.77
▸ MAOA P21397 14/20 0.69
▸ MAOB P27338 11/20 0.69
▸ HDAC1 Q13547 3/20 0.68
▸ KDM1B Q8NB78 9/20 0.64
▸ HDAC3 O15379 1/20 0.59
▸ HDAC2 Q92769 1/20 0.59

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
SCHEMBL24890607 1.00 KDM1A (0.77) KDM1ARCOR1MAOAMAOBHDAC1
SCHEMBL24890499 1.00 KDM1A (0.77) KDM1ARCOR1MAOAMAOBHDAC1
SCHEMBL24890585 0.89 HDAC1 (0.76) KDM1ARCOR1MAOAMAOBHDAC1
SCHEMBL24890620 0.89 HDAC1 (0.76) KDM1ARCOR1MAOAMAOBHDAC1
SCHEMBL24890724 0.89 HDAC1 (0.76) KDM1ARCOR1MAOAMAOBHDAC1
SCHEMBL24890458 0.89 HDAC1 (0.76) KDM1ARCOR1MAOAMAOBHDAC1
SCHEMBL24890688 0.88 HDAC1 (0.61) KDM1ARCOR1MAOAMAOBHDAC1
SCHEMBL24890496 0.87 KDM1A (0.58) KDM1ARCOR1MAOAMAOBHDAC1
SCHEMBL24890647 0.87 KDM1A (0.66) KDM1ARCOR1MAOAMAOBHDAC1
SCHEMBL24890639 0.87 KDM1A (0.58) KDM1ARCOR1MAOAMAOBHDAC1

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
WO-2023284651-A1 N-(2-AMINOPHENYL)BENZAMIDE COMPOUND AND APPLICATION THEREOF 南京明德新药研发有限公司 2023-01-19 — — WO disclosed