SCHEMBL8557370

SCHEMBL8557370

C=C(C)c1c(C(=O)C(C)C)c2ccc(C(=O)OC)cc2n1Cc1ccccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.43
MAPT P10636 4/20 0.43
S1PR3 Q99500 2/20 0.42
DPP4 P27487 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
RXFP1 Q9HBX9 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
PLA2G2A P14555 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ALOX5AP P20292 1/20 0.37
POLB P06746 1/20 0.37
EGLN3 Q9H6Z9 1/20 0.37

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
SCHEMBL7471087 0.86 L3MBTL1 (0.49) TP53MAPTS1PR3DPP4ALDH1A1
SCHEMBL7468891 0.85 MAPT (0.44) TP53MAPTS1PR3DPP4ALDH1A1
SCHEMBL7418990 0.85 MAPT (0.44) TP53MAPTS1PR3DPP4ALDH1A1
SCHEMBL7415932 0.84 MAPT (0.43) TP53MAPTS1PR3DPP4ALDH1A1
SCHEMBL7425401 0.83 MAPT (0.43) TP53MAPTS1PR3DPP4ALDH1A1
SCHEMBL7476760 0.82 MAPT (0.44) TP53MAPTS1PR3DPP4ALDH1A1
SCHEMBL7418494 0.82 MAPT (0.44) TP53MAPTS1PR3DPP4ALDH1A1
SCHEMBL7419644 0.82 S1PR3 (0.44) TP53MAPTS1PR3DPP4ALDH1A1
SCHEMBL7419036 0.81 TP53 (0.44) TP53MAPTS1PR3DPP4ALDH1A1
SCHEMBL7472560 0.80 MAPT (0.49) TP53MAPTDPP4ALDH1A1KDM4E

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