SCHEMBL8180448

SCHEMBL8180448

CCCCC(N)C(O)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.39
SPHK1 Q9NYA1 2/20 0.39
TP53 P04637 2/20 0.39
GMNN O75496 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
THPO P40225 1/20 0.39
MTOR P42345 1/20 0.39
BLM P54132 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
CETP P11597 1/20 0.39
HTT P42858 1/20 0.39
UBE2N P61088 1/20 0.39
OPRM1 P35372 1/20 0.34
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
SLC1A3 P43003 1/20 0.33

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
SCHEMBL8180450 1.00 CYP2D6 (0.39) CYP2D6SPHK1TP53GMNNLMNA
SCHEMBL18923209 1.00 CYP2D6 (0.39) CYP2D6SPHK1TP53GMNNLMNA
SCHEMBL8975436 0.80 CETP (0.37) CETP
SCHEMBL9418108 0.77 SPHK1 (0.40) CYP2D6SPHK1TP53GMNNLMNA
SCHEMBL9418110 0.77 SPHK1 (0.40) CYP2D6SPHK1TP53GMNNLMNA
SCHEMBL3295923 0.77 CETP (0.36) KDM4ECETPTDP1
SCHEMBL26780682 0.77 CETP (0.36) KDM4ECETPTDP1
SCHEMBL18124784 0.76 SPHK1 (0.34) SPHK1MAPTOPRM1CA1CA2
SCHEMBL18124785 0.76 SPHK1 (0.34) SPHK1MAPTOPRM1CA1CA2
SCHEMBL18125144 0.76 SPHK1 (0.34) SPHK1MAPTOPRM1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6017887-A Peptide, peptide analog and amino acid analog protease inhibitors SIBIA NEUROSCIENCES, INC. (US) 2000-01-25 US claimed
US-5872101-A Methods of treating neurodegenerative disorders using protease inhibitors SIBIA NEUROSCIENCES, INC. (US) 1999-02-16 US claimed
US-5863902-A Methods of treating neurodegenerative disorders using protease inhibitors SIBIA NEUROSCIENCES, INC. (US) 1999-01-26 US claimed
US-6153171-A Methods for identifying compounds effective for treating neurodegenerative disorders and for monitoring the therapeutic intervention therefor SIBIA NEUROSCIENCES, INC. (US) 2000-11-28 US disclosed
US-6051684-A CONTACTING A COMPOSITION CONTAINING AMYLOID PRECURSOR PROTEIN WITH DI- OR TRIPEPTIDE ANALOG CAUSING A DECREASE IN A-BETA-PEPTIDE OR AN INCREASE IN ALPHA-S-AMYLOID PRECURSOR PROTEIN SIBIA NEUROSCIENCES INC. (US) 2000-04-18 US disclosed
US-6017887-A Peptide, peptide analog and amino acid analog protease inhibitors SIBIA NEUROSCIENCES, INC. (US) 2000-01-25 US disclosed
US-6015879-A COMPOUNDS FOR TREATMENT OF NERVOUS SYSTEM DISORDERS INCLUDING ALZHEIMER'S DISEASE, COGNITION DEFECTS, DOWN'S SYNDROME, PARKINSON'S DISEASE, CEREBRAL HEMORRHAGE WITH AMYLOIDOSIS, DEMENTIA PUGILISTICA, AND HEAD TRAUMA SIBIA NEUROSCIENCES, INC. (US) 2000-01-18 US disclosed
US-5969100-A Peptide, peptide analog and amino acid analog protease inhibitors SIBIA NEUROSCIENCES, INC. (US) 1999-10-19 US disclosed
US-5962419-A NERVOUS SYSTEM DISORDERS; BRAIN DISORDERS SIBIA NEUROSCIENCES, INC. (US) 1999-10-05 US disclosed
US-5872101-A Methods of treating neurodegenerative disorders using protease inhibitors SIBIA NEUROSCIENCES, INC. (US) 1999-02-16 US disclosed
US-5863902-A Methods of treating neurodegenerative disorders using protease inhibitors SIBIA NEUROSCIENCES, INC. (US) 1999-01-26 US disclosed
US-5804560-A MODULATES PROCESSING OF AMYLOID PRECURSOR PROTEIN SIBIA NEUROSCIENCES, INC. (US) 1998-09-08 US disclosed
US-5714471-A USEFUL IN INDICATING NEURODEGENERATIVE DISORDERS CHARACTERIZED BY DEPOSITION OF CEREBRAL AMYLOID SIBIA NEUROSCIENCES, INC. (US) 1998-02-03 US disclosed
WO-1996020949-A1 PEPTIDE AND PEPTIDE ANALOG PROTEASE INHIBITORS SIBIA NEUROSCIENCES, INC. (US) 1996-07-11 WO disclosed
WO-1996020725-A2 PEPTIDE, PEPTIDE ANALOG AND AMINO ACID ANALOG PROTEASE INHIBITORS SIBIA NEUROSCIENCES, INC. (US) 1996-07-11 WO disclosed