SCHEMBL28236290

SCHEMBL28236290

NC(=NO)NCCCC(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.47
ADRA1A P35348 1/20 0.44
ATM Q13315 1/20 0.41
PLA2G4A P47712 1/20 0.41
LMNA P02545 4/20 0.40
SLC22A6 Q4U2R8 1/20 0.40
EPHX2 P34913 2/20 0.40
FABP4 P15090 1/20 0.40
TSHR P16473 2/20 0.39
GABRR3 A8MPY1 1/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
HDAC3 O15379 1/20 0.39
GABBR2 O75899 1/20 0.39
CYP1A2 P05177 1/20 0.39
THRB P10828 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRR1 P24046 1/20 0.39

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
SCHEMBL17234580 0.83 PRMT1 (0.47) PRMT1ADRA1AATMPLA2G4ALMNA
SCHEMBL466337 0.83 PRMT1 (0.47) PRMT1ADRA1AATMPLA2G4ALMNA
SCHEMBL19933297 0.82 ADRA1A (0.47) PRMT1ADRA1AATMPLA2G4ALMNA
SCHEMBL25366603 0.80 PRMT1 (0.44) PRMT1ADRA1AATMPLA2G4ALMNA
SCHEMBL2035521 0.78 PRMT1 (0.54) PRMT1ADRA1AATMPLA2G4ALMNA
SCHEMBL585705 0.78 PRMT1 (0.55) PRMT1ADRA1ALMNAEPHX2TSHR
SCHEMBL8944734 0.76 PRMT1 (0.59) PRMT1ADRA1APLA2G4ALMNAEPHX2
SCHEMBL33717 0.74 PRMT1 (0.50) PRMT1ADRA1AATMPLA2G4ALMNA
SCHEMBL31372702 0.74 PRMT1 (0.50) PRMT1ADRA1AATMPLA2G4ALMNA
SCHEMBL3280998 0.74 PRMT1 (0.50) PRMT1ADRA1AATMPLA2G4ALMNA

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
CN-108367043-A The conjugate of quaternized tubulysin compound 西雅图基因公司 2018-08-03 CN disclosed