SCHEMBL8551585

SCHEMBL8551585

CCCc1[nH]c2cc(C(=O)OC)cc(Cc3ccccc3Cl)c2c1C(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 2/20 0.48
ALOX5 P09917 2/20 0.46
PDE3B Q13370 1/20 0.46
PDE3A Q14432 1/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PPARG P37231 3/20 0.42
PPARA Q07869 3/20 0.42
PTGES O14684 1/20 0.41
GPR84 Q9NQS5 1/20 0.38
ALDH1A1 P00352 1/20 0.37
PKM P14618 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
POLB P06746 1/20 0.36
KIF11 P52732 1/20 0.36
HSP90AA1 P07900 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
SCHEMBL8553605 0.92 ALOX5 (0.48) SMN1; SMN2LMNAALOX5PDE3BPDE3A
SCHEMBL8555588 0.91 SMN1; SMN2 (0.47) SMN1; SMN2LMNAALOX5PDE3BPDE3A
SCHEMBL8554409 0.90 LMNA (0.47) SMN1; SMN2LMNAALOX5PDE3BPDE3A
SCHEMBL251645 0.90 ALOX5 (0.43) SMN1; SMN2LMNAALOX5PDE3BPDE3A
SCHEMBL8551861 0.87 ALOX5 (0.41) SMN1; SMN2LMNAALOX5PDE3BPDE3A
SCHEMBL8551838 0.85 LMNA (0.55) SMN1; SMN2LMNAALOX5PDE3BPDE3A
SCHEMBL8551933 0.82 PDE3B (0.51) SMN1; SMN2LMNAALOX5PDE3BPDE3A
SCHEMBL7707823 0.81 ALOX5 (0.44) SMN1; SMN2LMNAALOX5PDE3BPDE3A
SCHEMBL8557469 0.79 PDE3B (0.52) SMN1; SMN2LMNAALOX5PDE3BPDE3A
SCHEMBL8554263 0.79 ALOX5 (0.39) SMN1; SMN2LMNAALOX5PDE3BPDE3A

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