SCHEMBL11360451

SCHEMBL11360451

CCCCOC(=O)c1cccc(C=Cc2ccccc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
LMNA P02545 3/20 0.54
TDP1 Q9NUW8 4/20 0.53
TSHR P16473 4/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
TP53 P04637 1/20 0.52
MAPT P10636 1/20 0.52
CYP1A2 P05177 3/20 0.51
CYP2C19 P33261 3/20 0.51
CYP2C9 P11712 2/20 0.51
NPC1 O15118 1/20 0.51
HPGD P15428 1/20 0.51
RAB9A P51151 1/20 0.51
ESR1 P03372 5/20 0.50
MAPK1 P28482 2/20 0.50
CYP2D6 P10635 1/20 0.50
NR1H2 P55055 1/20 0.50
RNASEL Q05823 1/20 0.50
CNR2 P34972 1/20 0.50

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
SCHEMBL11360450 1.00 KDM4E (0.55) KDM4ELMNATDP1TSHRL3MBTL1
SCHEMBL9099896 0.86 L3MBTL1 (0.54) LMNATDP1TSHRL3MBTL1SMN1; SMN2
SCHEMBL11360421 0.85 PPARG (0.54) KDM4ELMNAL3MBTL1SMN1; SMN2MAPT
SCHEMBL27295656 0.85 PPARG (0.54) KDM4ELMNAL3MBTL1SMN1; SMN2MAPT
SCHEMBL11360426 0.85 PPARG (0.54) KDM4ELMNAL3MBTL1SMN1; SMN2MAPT
SCHEMBL22887355 0.85 TDP1 (0.46) KDM4ELMNATDP1SMN1; SMN2TP53
SCHEMBL111861 0.83 L3MBTL1 (0.64) LMNATDP1TSHRL3MBTL1SMN1; SMN2
Lithium SCHEMBL30876327 0.82 L3MBTL1 (0.62) LMNATDP1TSHRL3MBTL1SMN1; SMN2
SCHEMBL7189257 0.82 L3MBTL1 (0.62) LMNATDP1TSHRL3MBTL1SMN1; SMN2
SCHEMBL97514 0.82 LMNA (0.79) LMNATDP1TSHRL3MBTL1SMN1; SMN2

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
US-4271186-A Stilbene compounds and insecticidal/acaricidal compositions BAYER AKTIENGESELLSCHAFT (DE) 1981-06-02 US disclosed