SCHEMBL6624637

SCHEMBL6624637

CCOC(=O)CNC1CCc2c(-c3ccccc3)[nH]c3cccc1c23

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
PARP1 P09874 3/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 3/20 0.38
GAA P10253 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
LMNA P02545 3/20 0.37
MEN1 O00255 2/20 0.37
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
HSD17B10 Q99714 2/20 0.37
HPGD P15428 1/20 0.37
MAPK10 P53779 1/20 0.37
PPID Q08752 1/20 0.37
NTRK1 P04629 2/20 0.36
BCHE P06276 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 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
Hydrochloric Acid SCHEMBL8222171 0.99 POLB (0.40) POLBPARP1ALDH1A1KDM4EGAA
SCHEMBL6623672 0.91 PARP1 (0.41) PARP1CD274BCHEMAOAMAOB
SCHEMBL6623902 0.86 PARP1 (0.44) PARP1ALDH1A1CD274MAOAMAOB
Hydrochloric Acid SCHEMBL6624623 0.83 PARP1 (0.41) PARP1ALDH1A1CD274MAOAMAOB
SCHEMBL6626911 0.80 PARP1 (0.40) POLBPARP1ALDH1A1KDM4EGAA
SCHEMBL6627765 0.80 PARP1 (0.44) POLBPARP1KDM4ECD274LMNA
Hydrochloric Acid SCHEMBL6627074 0.80 PARP1 (0.39) POLBPARP1ALDH1A1KDM4EGAA
SCHEMBL6625091 0.79 MAPT (0.39) PARP1ALDH1A1KDM4EGAASMN1; SMN2
SCHEMBL6622618 0.79 CDC42 (0.46) PARP1GAACD274
SCHEMBL6624331 0.78 SCN3A (0.36) PARP1SMN1; SMN2CD274LMNABCHE

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
EP-0858996-B1 NERVE CELL PROTECTIVE AGENTS MOCHIDA PHARM CO LTD (JP) 2004-10-27 EP disclosed
US-6040331-A Nerve cell protective agents MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-03-21 US disclosed
EP-0858996-A1 NERVE CELL PROTECTIVE AGENTS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1998-08-19 EP disclosed