SCHEMBL28643483

SCHEMBL28643483

O=C(N[C@H](CCN[C@@H]1C[C@H]1c1ccc(F)cc1)C(=O)N1CCS(=O)(=O)CC1)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 20/20 0.66

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
SCHEMBL18016668 1.00 KDM1A (0.66) KDM1A
SCHEMBL18016673 0.81 MDM4 (0.45) —
SCHEMBL18016669 0.80 KDM1A (0.43) KDM1A
SCHEMBL28638074 0.80 KDM1A (0.43) KDM1A
SCHEMBL18016476 0.80 KDM1A (1.00) KDM1A
SCHEMBL18016710 0.79 KDM1A (1.00) KDM1A
SCHEMBL18016703 0.79 KDM1A (1.00) KDM1A
SCHEMBL18016708 0.77 KDM1A (1.00) KDM1A
SCHEMBL25182896 0.77 CASP3 (0.49) —
SCHEMBL29855069 0.77 CASP3 (0.49) —

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-107427699-B KDM1A inhibitors for the treatment of disease 伊美格生物科学公司 2021-10-19 — — CN disclosed
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