SCHEMBL7986153

SCHEMBL7986153

Cc1ccc(CO[C@H](COCc2ccccc2F)[C@@H](O)[C@H](O)[C@@H](COCc2ccccc2F)OCc2ccc(C)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
THRB P10828 1/20 0.38
IDO1 P14902 2/20 0.36
MAOB P27338 4/20 0.36
SCN9A Q15858 1/20 0.35
HPGD P15428 1/20 0.35
PTPN2 P17706 1/20 0.35
PTPN1 P18031 1/20 0.35
CDC25B P30305 1/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL7987648 0.90 HSP90AA1 (0.39) LMNATDP1ALDH1A1KDM4EMEN1
SCHEMBL7989824 0.90 ALDH1A1 (0.39) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL7989289 0.89 CA1 (0.42) ALDH1A1MEN1MAPK1KMT2AIDO1
SCHEMBL7989311 0.88 CA1 (0.44) HTTALDH1A1MEN1MAPK1KMT2A
SCHEMBL7986279 0.88 CA1 (0.45) LMNAMAPTHTTALDH1A1MEN1
SCHEMBL7989863 0.87 IDO1 (0.36) LMNAALDH1A1MEN1MAPK1KMT2A
SCHEMBL7987303 0.87 HSP90AA1 (0.43) TDP1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL7447822 0.86 HSP90AA1 (0.44) KDM4EMEN1MAPK1KMT2AIDO1
SCHEMBL7986289 0.84 IDO1 (0.38) LMNAMAPTHTTTDP1ALDH1A1
SCHEMBL7975758 0.84 MAOB (0.48) LMNAMAOBSCN9APTPN1

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
US-6313177-B1 AS ANTIVIRAL AGENTS PHARMACOR INC. (CA) 2001-11-06 US disclosed