SCHEMBL28407338

SCHEMBL28407338

C=CC=COC(=O)CCCCC

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
DGKA P23743 1/20 0.46
LMNA P02545 3/20 0.43
PAM P19021 2/20 0.42
MAPT P10636 2/20 0.41
MAPK1 P28482 1/20 0.41
CES2 O00748 4/20 0.40
CES1 P23141 4/20 0.40
TK1 P04183 1/20 0.40
FAAH O00519 1/20 0.40
TRPA1 O75762 1/20 0.39
AKR1B1 P15121 1/20 0.39
DNM1 Q05193 1/20 0.39
POLB P06746 1/20 0.39
POLA1 P09884 1/20 0.39
ALDH1A1 P00352 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
SCHEMBL28173939 0.98 TSHR (0.54) TSHRDGKALMNAPAMMAPT
SCHEMBL27685839 0.96 TSHR (0.53) TSHRDGKALMNAPAMMAPT
SCHEMBL28137672 0.94 TSHR (0.44) TSHRDGKALMNAPAMMAPT
SCHEMBL27691616 0.90 ALDH1A1 (0.39) TSHRDGKALMNAMAPTTK1
SCHEMBL28213970 0.88 LMNA (0.42) TSHRDGKALMNAPAMMAPT
SCHEMBL515679 0.84 DGKA (0.56) TSHRDGKALMNAPAMMAPT
SCHEMBL515678 0.84 DGKA (0.56) TSHRDGKALMNAPAMMAPT
SCHEMBL28085041 0.84 FASN (0.45) TSHRLMNAMAPTFAAHPOLB
SCHEMBL37988 0.82 DGKA (0.59) TSHRDGKALMNAPAMMAPT
SCHEMBL11553304 0.82 DGKA (0.59) TSHRDGKALMNAPAMMAPT

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-111240156-A Photosensitive resin composition, method for producing patterned cured film, and patterned cured film 东京应化工业株式会社 2020-06-05 CN disclosed