SCHEMBL23673989

SCHEMBL23673989

CN(c1ccc([Si](C)(C)C)cc1F)c1cnc(CO)cc1C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ASPH Q12797 1/20 0.31
▸ KDM8 Q8N371 1/20 0.31

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
SCHEMBL30866576 0.76 DHODH (0.37) KDM4EASPHKDM8
SCHEMBL30459905 0.67 MAP2K1 (0.35) KDM4E
SCHEMBL23673990 0.67 MAP2K1 (0.35) KDM4E
SCHEMBL27224628 0.66 MAP2K1 (0.38) KDM4EASPHKDM8
SCHEMBL8932122 0.65 KDM4E (0.43) KDM4EASPHKDM8
SCHEMBL28710108 0.61 ALDH1A1 (0.41) KDM4CALDH1A1KDM4EASPHKDM8
SCHEMBL9455801 0.61 ALDH1A1 (0.33) ALDH1A1
SCHEMBL8932031 0.60 ACHE (0.40) —
SCHEMBL24770298 0.60 DHODH (0.42) —
SCHEMBL27224638 0.60 DHODH (0.37) KDM4EASPHKDM8

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-2021149776-A1 ARYLAMIDE DERIVATIVE HAVING ANTITUMOR ACTIVITY 中外製薬株式会社 2021-07-29 — — WO disclosed
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