SCHEMBL28428366

SCHEMBL28428366

O=C(O)N(CCCCN(C(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.33
EYA2 O00167 1/20 0.33
APP P05067 1/20 0.33
ACE P12821 1/20 0.33
LMNA P02545 3/20 0.32
TSHR P16473 2/20 0.32
PMP22 Q01453 2/20 0.32
KDM4E B2RXH2 1/20 0.32
CHRM2 P08172 1/20 0.32
ADRA2A P08913 1/20 0.32
ALOX15 P16050 1/20 0.32
DRD1 P21728 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
CYP2C19 P33261 1/20 0.32
ADRA1A P35348 1/20 0.32
DRD3 P35462 1/20 0.32
BLM P54132 1/20 0.32
SLC6A3 Q01959 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32

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
SCHEMBL4868996 0.97 TSHR (0.35) TDP1EYA2APPACELMNA
SCHEMBL19615405 0.86 TDP1 (0.32) TDP1EYA2APPACELMNA
SCHEMBL3753416 0.84 CAMK2A (0.41)
SCHEMBL9280314 0.84 GPR84 (0.48) TDP1APPTSHRALOX15SLC22A6
SCHEMBL537217 0.84 LMNA (0.48) LMNATSHRCHRM2ALOX15SLC6A2
SCHEMBL3230784 0.84 EYA2 (0.31) TDP1EYA2APPACETSHR
SCHEMBL3756453 0.82
SCHEMBL9051005 0.82 TSHR (0.33) TDP1EYA2APPACELMNA
SCHEMBL31662731 0.81 TDP1 (0.35) TDP1EYA2APPACELMNA
Magnesium SCHEMBL3108011 0.79 TDP1 (0.33) TDP1EYA2APPACELMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111303122-A Pomalidomide derivative and application thereof 南方医科大学 2020-06-19 CN claimed
CN-111303122-A Pomalidomide derivative and application thereof 南方医科大学 2020-06-19 CN disclosed
CN-111303122-A Pomalidomide derivative and application thereof 南方医科大学 2020-06-19 CN disclosed