SCHEMBL8913213

SCHEMBL8913213

C=CC(=O)N(CCC)CCCC1Cc2ccc(-c3ccc(=O)[nH]n3)cc2C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
PDE3B Q13370 4/20 0.35
PDE3A Q14432 4/20 0.35
PDE4A P27815 3/20 0.34
PDE4B Q07343 3/20 0.34
PDE4C Q08493 3/20 0.34
PDE4D Q08499 3/20 0.34
LMNA P02545 3/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
P2RX7 Q99572 1/20 0.31
SLC6A2 P23975 3/20 0.31
SLC6A3 Q01959 3/20 0.31
SLC6A4 P31645 2/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL8913328 0.95 MAPT (0.38) MAPTPDE3BPDE3APDE4APDE4B
SCHEMBL8912661 0.79 PDE3B (0.38) MAPTPDE3BPDE3APDE4APDE4B
SCHEMBL8914142 0.78 PDE3B (0.37) MAPTPDE3BPDE3APDE4APDE4B
SCHEMBL8911348 0.76 PDE3B (0.39) MAPTPDE3BPDE3APDE4APDE4B
SCHEMBL8912147 0.76 KDM4E (0.40) MAPTPDE3BPDE3APDE4APDE4B
SCHEMBL8291725 0.74 PDE3B (0.41) MAPTPDE3BPDE3APDE4APDE4B
SCHEMBL8292411 0.74 PDE3B (0.42) MAPTPDE3BPDE3APDE4APDE4B
SCHEMBL8298502 0.73 PDE3B (0.38) MAPTPDE3BPDE3APDE4APDE4B
Bromide SCHEMBL8298175 0.73 PDE3B (0.41) MAPTPDE3BPDE3APDE4APDE4B
SCHEMBL8291609 0.72 PDE3B (0.37) MAPTPDE3BPDE3APDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5605901-A THERAPY FOR GRAM-NEGATIVE BACTERIA, NEPHRITIS TANABE SEIYAKU CO., LTD. (JP) 1997-02-25 US claimed
EP-0661274-A1 Indane derivatives, processes for preparing the same and synthetic intermediate of the same TANABE SEIYAKU CO., LTD. (JP) 1995-07-05 EP claimed