SCHEMBL8555747

SCHEMBL8555747

CCCc1[nH]c2cc(C(=O)O)cc(Cc3ccccc3Cl)c2c1CCCCCCCCCCCCCCCCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 4/20 0.39
CNR1 P21554 3/20 0.39
CNR2 P34972 2/20 0.39
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39
ALOX5 P09917 1/20 0.38
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PLAAT3 P53816 1/20 0.36
PLAAT5 Q96KN8 1/20 0.36
PLAAT2 Q9NWW9 1/20 0.36
PLAAT4 Q9UL19 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36
PLK3 Q9H4B4 3/20 0.35
PPARG P37231 1/20 0.35
GRIN1 Q05586 1/20 0.35
GPR17 Q13304 2/20 0.35
MCL1 Q07820 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
SCHEMBL7424550 0.83 ALOX5 (0.39) CNR1CNR2PDE3BPDE3AALOX5
SCHEMBL251645 0.82 ALOX5 (0.43) PDE3BPDE3AALOX5LMNASMN1; SMN2
SCHEMBL8553612 0.78 PDE3B (0.43) CNR1PDE3BPDE3AALOX5LMNA
SCHEMBL7707823 0.76 ALOX5 (0.44) CNR1PDE3BPDE3AALOX5LMNA
SCHEMBL5797940 0.76 PPARG (0.49) ALOX5PPARGMCL1
SCHEMBL8555588 0.74 SMN1; SMN2 (0.47) PDE3BPDE3AALOX5LMNASMN1; SMN2
SCHEMBL8557456 0.73 LMNA (0.48) PDE3BPDE3AALOX5LMNASMN1; SMN2
SCHEMBL8551585 0.73 SMN1; SMN2 (0.48) PDE3BPDE3AALOX5LMNASMN1; SMN2
SCHEMBL8557542 0.72 LMNA (0.42) PDE3BPDE3ALMNASMN1; SMN2GRIN1
SCHEMBL8554263 0.72 ALOX5 (0.39) CNR1PDE3BPDE3AALOX5LMNA

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
EP-0820441-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-01-28 EP disclosed