SCHEMBL8588735

SCHEMBL8588735

COC(=O)c1ccc(OCCCCCCCCCCOc2ccc(C(=O)OC)c(C(=O)OC)c2)cc1C(=O)OC

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.53
MAOA P21397 3/20 0.53
MAPT P10636 2/20 0.51
GAA P10253 1/20 0.47
PTPN11 Q06124 2/20 0.47
RAB9A P51151 1/20 0.46
KDM4E B2RXH2 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL16836640 0.94 MAOA (0.62) MAOBMAOAPTPN11THRATHRB
SCHEMBL24830103 0.92 MAPT (0.49) MAOBMAOAMAPTGAAPTPN11
SCHEMBL8085882 0.92 MAOA (0.60) MAOBMAOAPTPN11THRATHRB
SCHEMBL8973177 0.92 KDM4E (0.53) MAOBMAOAMAPTRAB9AKDM4E
SCHEMBL27098581 0.92 MAPT (0.47) MAOBMAOAMAPTPTPN11RAB9A
SCHEMBL21543811 0.92 MAOA (0.55) MAOBMAOAMAPTPTPN11KDM4E
SCHEMBL7157499 0.91 MAPT (0.60) MAPTPTPN11RAB9AKDM4ECYP1A2
SCHEMBL18199320 0.88 PLA2G2A (0.50) MAOBMAOAMAPTGAARAB9A
SCHEMBL11454639 0.87 MAPT (0.60) MAPTPTPN11RAB9AKDM4ECYP1A2
SCHEMBL23250015 0.87 MAPT (0.49) MAOBMAOAMAPTRAB9AKDM4E

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
JP-10130253-A None JP disclosed
JP-H10130253-A NEW ALICYCLIC TETRACARBOXYLIC ACID DIANHYDRIDE, ITS INTERMEDIATE AND PRODUCTION THEREOF HITACHI CHEM CO LTD 1998-05-19 JP disclosed