SCHEMBL30354555

SCHEMBL30354555

N=CCCOC(=O)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.63
LMNA P02545 2/20 0.59
F2 P00734 1/20 0.52
MAPK1 P28482 1/20 0.52
HIF1A Q16665 1/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A3 Q01959 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
TSHR P16473 2/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL27507951 0.89 TDP1 (0.70) TDP1LMNAF2MAPK1HIF1A
SCHEMBL27566628 0.86 TDP1 (0.71) TDP1LMNAMAPK1HIF1ASLC6A2
SCHEMBL2844201 0.83 TDP1 (0.66) TDP1LMNAF2MAPK1HIF1A
SCHEMBL137486 0.82 TDP1 (0.83) TDP1LMNAF2MAPK1HIF1A
SCHEMBL11518351 0.81 TDP1 (0.63) TDP1LMNAF2MAPK1HIF1A
SCHEMBL11458571 0.81 LMNA (0.65) TDP1LMNAF2MAPK1HIF1A
SCHEMBL529612 0.81 TDP1 (0.63) TDP1LMNAF2MAPK1HIF1A
SCHEMBL27957188 0.81 TDP1 (0.57) TDP1LMNAF2MAPK1HIF1A
SCHEMBL547137 0.80 TDP1 (0.79) TDP1LMNAF2MAPK1HIF1A
SCHEMBL13292516 0.80 TDP1 (0.79) TDP1LMNAF2MAPK1HIF1A

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-112759672-B Solid catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2023-04-11 CN claimed