SCHEMBL21879686

SCHEMBL21879686

O=C(O)c1c(-c2ccccc2)c(-c2ccccc2)c2ccccc2c1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.51
KDM4E B2RXH2 7/20 0.46
ALDH1A1 P00352 4/20 0.46
HPGD P15428 3/20 0.46
GLA P06280 2/20 0.45
HSD17B10 Q99714 2/20 0.45
MEN1 O00255 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 1/20 0.45
PDE10A Q9Y233 3/20 0.43
DHODH Q02127 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
TSHR P16473 2/20 0.42
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.41
PIM1 P11309 1/20 0.41
GFER P55789 1/20 0.41
AGTR1 P30556 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL27724475 0.92 LMNA (0.56) LMNAKDM4EALDH1A1HPGDGLA
SCHEMBL29262209 0.87 LMNA (0.55) LMNAKDM4EALDH1A1HPGDGLA
SCHEMBL1635941 0.84 LMNA (0.50) LMNAKDM4EALDH1A1HPGDGLA
SCHEMBL338936 0.84 DHODH (0.49) LMNAKDM4EALDH1A1HPGDGLA
SCHEMBL8708272 0.82 LMNA (0.47) LMNAKDM4EALDH1A1HPGDGLA
SCHEMBL351262 0.82 LMNA (0.48) LMNAKDM4EALDH1A1HPGDDHODH
SCHEMBL5607121 0.82 LMNA (0.48) LMNAKDM4EALDH1A1HPGDGLA
SCHEMBL10405305 0.82 LMNA (0.48) LMNAKDM4EALDH1A1HPGDGLA
SCHEMBL3446771 0.82 LMNA (0.52) LMNAKDM4EALDH1A1HPGDGLA
SCHEMBL29094128 0.80 CDC25B (0.50) LMNAALDH1A1HPGDMEN1KMT2A

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
WO-2020085686-A1 POLYMERIZABLE COMPOSITION, AND COPOLYCARBONATE ESTER AND METHOD FOR PRODUCING SAME 에스케이케미칼 주식회사 2020-04-30 WO claimed