SCHEMBL28637211

SCHEMBL28637211

CCCCC(OC(=O)c1ccc(C(=O)OC(CCCC)c2ccccc2)cc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 4/20 0.51
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
POLB P06746 3/20 0.46
PDCD1 Q15116 1/20 0.45
CD274 Q9NZQ7 1/20 0.45
ALDH1A1 P00352 5/20 0.44
MAPK1 P28482 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
UBE2N P61088 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL828450 0.96 UTS2R (0.48) UTS2RESR1ESR2POLBPDCD1
SCHEMBL2455385 0.92 ALDH1A1 (0.48) UTS2RESR1ESR2POLBALDH1A1
SCHEMBL9341086 0.91 ALDH1A1 (0.50) UTS2RALDH1A1TSHRMEN1KMT2A
SCHEMBL1959729 0.88 ALDH1A1 (0.56) UTS2RPOLBALDH1A1MAPK1TSHR
SCHEMBL27399397 0.87 UTS2R (0.50) UTS2RESR1ESR2POLBPDCD1
SCHEMBL1785848 0.87 TSHR (0.52) UTS2RESR1ESR2POLBPDCD1
SCHEMBL19920986 0.86 KMT2A (0.43) UTS2RPOLBALDH1A1KMT2A
SCHEMBL1836927 0.85 POLB (0.49) POLBALDH1A1LMNANPC1RAB9A
SCHEMBL1836929 0.85 POLB (0.49) POLBALDH1A1LMNANPC1RAB9A
SCHEMBL6666615 0.84 PABPC1 (0.50) POLBALDH1A1

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-108300362-B Adhesive tape 日东电工株式会社 2021-09-17 CN disclosed