SCHEMBL27643168

SCHEMBL27643168

CC(O)C(=O)c1cc[c]cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
PGR P06401 1/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
HTR2A P28223 1/20 0.33
HRH1 P35367 1/20 0.33
KCNH2 Q12809 1/20 0.33
KDM4E B2RXH2 2/20 0.32
DBH P09172 1/20 0.32
GAA P10253 1/20 0.32
RECQL P46063 1/20 0.32
TP53 P04637 1/20 0.32
GSK3B P49841 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
ESR2 Q92731 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SLC6A2 P23975 1/20 0.31

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
SCHEMBL4316411 0.84 KDM4E (0.47) LMNACES2CES1PGRADRA2A
SCHEMBL21456599 0.83 KDM4E (0.43) LMNACES2CES1PGRADRA2A
SCHEMBL1714628 0.81 CES2 (0.37) LMNACES2CES1GSK3BL3MBTL1
SCHEMBL17201709 0.81 SPHK1 (0.32) LMNACES2CES1PGRADRA2A
SCHEMBL27338904 0.80 ELANE (0.33) LMNAPGRADRA2AADRA2BHTR2A
SCHEMBL28131090 0.80 KMT2A (0.36) LMNAPGRADRA2AADRA2BHTR2A
SCHEMBL27262005 0.80 ELANE (0.33) LMNAPGRADRA2AADRA2BHTR2A
SCHEMBL28318760 0.77 HSD17B10 (0.38) LMNAPGRADRA2AADRA2BHTR2A
SCHEMBL9651524 0.77 LMNA (0.39) LMNAPGRADRA2AADRA2BHTR2A
SCHEMBL27601754 0.77 SLC7A5 (0.38) LMNAPGRADRA2AADRA2BHTR2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1860165-B Flame retardant compositions CIBA SC HOLDING AG 2010-04-14 CN disclosed
CN-1860165-A Flame retardant compositions CIBA SC HOLDING AG (CH) 2006-11-08 CN disclosed