SCHEMBL8310139

SCHEMBL8310139

CC(OS(=O)(=O)C(F)(F)F)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.44
▸ LMNA P02545 1/20 0.43
▸ CASP3 P42574 1/20 0.40
▸ TP53 P04637 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ MAPT P10636 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ HTT P42858 1/20 0.36
▸ VDR P11473 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ GAA P10253 1/20 0.36

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
SCHEMBL13026882 0.78 TDP1 (0.51) TDP1LMNACASP3TP53ALDH1A1
SCHEMBL13026902 0.78 TDP1 (0.51) TDP1LMNACASP3TP53ALDH1A1
SCHEMBL7598734 0.74 TDP1 (0.52) TDP1LMNACASP3TP53ALDH1A1
SCHEMBL15042285 0.72 TDP1 (0.50) TDP1LMNACASP3TP53ALDH1A1
SCHEMBL29368754 0.71 ALDH1A1 (0.61) LMNAALDH1A1MAPTKMT2AKDM4E
SCHEMBL64157 0.71 ALDH1A1 (0.61) LMNAALDH1A1MAPTKMT2AKDM4E
SCHEMBL13829003 0.69 HCAR2 (0.39) TDP1LMNAALDH1A1MAPTKMT2A
SCHEMBL7277995 0.69 TDP1 (0.47) TDP1LMNACASP3TP53ALDH1A1
SCHEMBL28419506 0.69 HCAR2 (0.39) TDP1LMNAALDH1A1MAPTKMT2A
SCHEMBL13108155 0.69 TDP1 (0.48) TDP1LMNACASP3ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0646116-B1 PROCESS AND INTERMEDIATES FOR BIS-AZA-BICYCLIC ANXIOLYTIC AGENTS PFIZER (US) 1999-10-13 — — EP disclosed
US-5719286-A Process and intermediates for bis-aza-bicyclic anxiolytic agents PFIZER INC. (US) 1998-02-17 — — US disclosed
EP-0586376-B1 Process and intermediates for the preparation of anxiolytic perhydro-1H-pyrido[1,2-a]pyrazines PFIZER (US) 1997-05-28 — — EP disclosed
WO-1995031572-A1 AMINOHYDROCARBON PHOSPHONATE OLIGONUCLEOTIDES AND USES THEREFOR PHARMGENICS, INC. (US) 1995-11-23 — — WO disclosed
US-5455350-A Process and intermediate for certain bis-aza-bicyclic anxiolytic agents PFIZER INC. (US) 1995-10-03 — — US disclosed
EP-0573467-B1 NEUROLEPTIC PERHYDRO-1H-PYRIDO 1,2-a]PYRAZINES PFIZER (US) 1995-05-31 — — EP disclosed
EP-0646116-A1 PROCESS AND INTERMEDIATES FOR BIS-AZA-BICYCLIC ANXIOLYTIC AGENTS PFIZER INC. (US) 1995-04-05 — — EP disclosed
EP-0586376-A1 PROCESS AND INTERMEDIATE FOR CERTAIN BIS-AZA-BICYCLIC ANXIOLYTIC AGENTS. PFIZER (US) 1994-03-16 — — EP disclosed
WO-1993025552-A1 PROCESS AND INTERMEDIATES FOR BIS-AZA-BICYCLIC ANXIOLYTIC AGENTS PFIZER INC. (US) 1993-12-23 — — WO disclosed
EP-0573467-A1 NEUROLEPTIC PERHYDRO-1H-PYRIDO 1,2-a]PYRAZINES. PFIZER (US) 1993-12-15 — — EP disclosed
US-5185449-A PROCESS AND INTERMEDIATE FOR CERTAIN BIS-AZA-BICYCLIC ANXIOLYTIC AGENTS PFIZER INC. (US) 1993-02-09 — — US disclosed
US-5157034-A Neuroleptic perhydro-1H-pyrido[1,2-a]pyrazines PFIZER INC. (US) 1992-10-20 — — US disclosed
WO-1992015575-A1 PROCESS AND INTERMEDIATE FOR CERTAIN BIS-AZA-BICYCLIC ANXIOLYTIC AGENTS PFIZER INC. (US) 1992-09-17 — — WO disclosed
WO-1992015580-A1 NEUROLEPTIC PERHYDRO-1H-PYRIDO[1,2-a]PYRAZINES PFIZER INC. (US) 1992-09-17 — — WO disclosed
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