SCHEMBL1007354

SCHEMBL1007354

COC(=O)C1CC2=C(CC(Cc3ccccc3)C2=O)N1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 1/20 0.39
MMP2 P08253 1/20 0.39
ANPEP P15144 1/20 0.39
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LTA4H P09960 2/20 0.36
ACHE P22303 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
SCHEMBL2074479 0.88 KLK7 (0.44) FKBP1AMMP2ANPEPPSEN1PSEN2
SCHEMBL1006401 0.77 MMP2 (0.36) MMP2ANPEPKMT2ATSHRALDH1A1
SCHEMBL1004592 0.70 MMP2 (0.37) MMP2ANPEPKMT2AMAPT
SCHEMBL1003699 0.70 SIGMAR1 (0.36) KMT2AMEN1ALDH1A1
SCHEMBL14893328 0.69 ALDH1A1 (0.46) FKBP1APSEN1PSEN2APH1BNCSTN
SCHEMBL2579480 0.69 P2RX7 (0.55) FKBP1APSEN1PSEN2APH1BNCSTN
SCHEMBL2579481 0.69 P2RX7 (0.55) FKBP1APSEN1PSEN2APH1BNCSTN
SCHEMBL17442799 0.67 DRD2 (0.55) DRD2DRD4
SCHEMBL9753059 0.67 ALDH1A1 (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9753061 0.67 ALDH1A1 (0.46) PSEN1PSEN2APH1BNCSTNAPH1A

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
WO-2011011330-A2 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2011-01-27 WO disclosed