SCHEMBL29675282

SCHEMBL29675282

C=CCc1c(C#N)c(C#N)c(C#N)c2c1[nH]c1ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ HSD17B10 Q99714 4/20 0.42
▸ DYRK1A Q13627 3/20 0.42
▸ MAPT P10636 3/20 0.42
▸ HPGD P15428 2/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ CLK1 P49759 2/20 0.42
▸ HTT P42858 3/20 0.39
▸ TSHR P16473 1/20 0.39
▸ CDK5 Q00535 3/20 0.39
▸ CDK5R1 Q15078 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL29171464 0.79 DYRK1A (0.53) KDM4EALDH1A1HSD17B10DYRK1AMAPT
SCHEMBL9696662 0.74 PDE9A (0.41) KDM4EALDH1A1HSD17B10DYRK1AMAPT
SCHEMBL29390086 0.69 DYRK1A (0.46) KDM4EALDH1A1HSD17B10DYRK1AMAPT
SCHEMBL6402986 0.68 MAPT (0.59) KDM4EALDH1A1MAPTHPGDALOX15
SCHEMBL6576224 0.67 MAPK1 (0.46) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL28181864 0.66 CHRNB2 (0.43) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL10453934 0.66 KIF11 (0.44) KDM4EALDH1A1HSD17B10MAPTALOX15
SCHEMBL1077319 0.65 ALDH1A1 (0.40) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL24471485 0.64 ALDH1A1 (0.51) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL241852 0.64 KIF11 (0.49) KDM4EALDH1A1HSD17B10MAPTHPGD

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-114585736-A Puromycin linker and application thereof in-vitro nucleic acid display peptide synthesis 北京寻因生物科技有限公司 2022-06-03 — — CN disclosed
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