SCHEMBL8621598

SCHEMBL8621598

CCCc1[nH]c2c(C(=O)OC)cccc2c1C(C)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
ALDH1A1 P00352 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MAPT P10636 2/20 0.47
KDM4E B2RXH2 1/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PIM1 P11309 2/20 0.46
PIM3 Q86V86 2/20 0.46
NR4A2 P43354 5/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ATM Q13315 1/20 0.41
CLEC4M Q9H2X3 1/20 0.40
CREBBP Q92793 1/20 0.40
RIPK1 Q13546 1/20 0.38
MAP2K1 Q02750 1/20 0.37
GAA P10253 1/20 0.37
JAK2 O60674 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
SCHEMBL7410219 0.92 LMNA (0.49) LMNAALDH1A1L3MBTL1MAPTKDM4E
SCHEMBL7469182 0.86 LMNA (0.47) LMNAALDH1A1L3MBTL1MAPTKDM4E
SCHEMBL7410235 0.85 LMNA (0.44) LMNAALDH1A1L3MBTL1MAPTKDM4E
SCHEMBL7411523 0.82 OXER1 (0.44) LMNAALDH1A1L3MBTL1MAPTKDM4E
SCHEMBL7412570 0.81 LMNA (0.48) LMNAALDH1A1L3MBTL1MAPTKDM4E
SCHEMBL7407743 0.76 NR4A2 (0.44) LMNAALDH1A1L3MBTL1MAPTKDM4E
SCHEMBL6686573 0.72 AHR (0.51) LMNAALDH1A1L3MBTL1MAPTKDM4E
SCHEMBL14555859 0.72 OXER1 (0.53) LMNAALDH1A1KDM4EHPGDNR4A2
SCHEMBL7423432 0.72 KMT2A (0.62) ALDH1A1L3MBTL1KDM4EHPGDHTT
SCHEMBL7474876 0.71 NR4A2 (0.61) LMNAALDH1A1L3MBTL1KDM4EHPGD

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