SCHEMBL21184262

SCHEMBL21184262

CCNc1c[nH]c(=O)[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.54
▸ MEN1 O00255 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ TAAR1 Q96RJ0 1/20 0.54
▸ LMNA P02545 3/20 0.50
▸ ATAD2 Q6PL18 1/20 0.47
▸ POLB P06746 4/20 0.44
▸ TP53 P04637 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ DPYD Q12882 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CYP19A1 P11511 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ THPO P40225 1/20 0.42
▸ MTOR P42345 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ HBB P68871 1/20 0.42
▸ PMP22 Q01453 1/20 0.42

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
SCHEMBL23133109 0.82 KDM4E (0.56) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL1518339 0.79 MAPT (0.50) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL31506926 0.79 KDM4E (0.54) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL30608338 0.77 MAPT (0.59) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL11879018 0.77 ATAD2 (0.52) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL668116 0.76 CYP3A4 (0.51) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL4961428 0.76 LMNA (0.54) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL23133247 0.74 MEN1 (0.52) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL31045646 0.73 CYP3A4 (0.56) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL28955974 0.72 ATAD2 (0.47) MAPTMEN1KMT2AKDM4ETAAR1

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-2019141009-A1 COMPOUND AND USE THEREOF IN MEDICINE 长沙霍滋生物科技有限公司 2019-07-25 — — WO disclosed
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