SCHEMBL27315605

SCHEMBL27315605

NCN[C@@H](Cc1ccc(O)c(O)c1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.59
▸ ALOX15 P16050 5/20 0.59
▸ HIF1A Q16665 5/20 0.59
▸ HSD17B10 Q99714 5/20 0.59
▸ RECQL P46063 4/20 0.59
▸ TDP1 Q9NUW8 4/20 0.59
▸ USP2 O75604 2/20 0.59
▸ ADORA3 P0DMS8 2/20 0.59
▸ HTR2A P28223 2/20 0.59
▸ PTGS2 P35354 2/20 0.59
▸ LCK P06239 2/20 0.59
▸ EGFR P00533 2/20 0.59
▸ PTGS1 P23219 2/20 0.59
▸ FYN P06241 1/20 0.59
▸ SLC7A5 Q01650 1/20 0.59
▸ CA1 P00915 5/20 0.59
▸ CA2 P00918 5/20 0.59
▸ KDM6B O15054 1/20 0.57
▸ MME P08473 1/20 0.50
▸ ACE P12821 1/20 0.50

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
SCHEMBL27285541 1.00 KDM4E (0.59) KDM4EALOX15HIF1AHSD17B10RECQL
SCHEMBL15117440 0.85 KDM4E (0.56) KDM4EALOX15HIF1AHSD17B10RECQL
SCHEMBL29700186 0.84 KDM6B (0.57) KDM4EALOX15HIF1AHSD17B10RECQL
Hydrochloric Acid SCHEMBL10782448 0.84 KDM6B (0.61) KDM4EALOX15HIF1AHSD17B10RECQL
SCHEMBL22364281 0.84 KDM6B (0.57) KDM4EALOX15HIF1AHSD17B10RECQL
SCHEMBL6340344 0.84 KDM6B (0.57) KDM4EALOX15HIF1AHSD17B10RECQL
SCHEMBL1718465 0.84 KDM6B (0.57) KDM4EALOX15HIF1AHSD17B10RECQL
SCHEMBL7433937 0.84 KDM6B (0.57) KDM4EALOX15HIF1AHSD17B10RECQL
SCHEMBL11529597 0.84 KDM4E (0.63) KDM4EALOX15HIF1AHSD17B10RECQL
SCHEMBL30287608 0.84 KDM4E (0.63) KDM4EALOX15HIF1AHSD17B10RECQL

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1062900-A The R-enantiomorph of N-propargyl-1-aminoidan, its method for making and contain its pharmaceutical composition ORVET BV (NL) 1992-07-22 — — CN claimed
CN-1031995-C R-enantiomers of N-propargyl-1-aminoindan compounds, their preparation and pharmaceutical compositions containing them ORVET BV (NL) 1996-06-12 — — CN disclosed
CN-1062900-A The R-enantiomorph of N-propargyl-1-aminoidan, its method for making and contain its pharmaceutical composition ORVET BV (NL) 1992-07-22 — — CN disclosed
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