SCHEMBL8092415

SCHEMBL8092415

CCOC(=O)CC1=Cc2cc(C)ccc2CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.39
NLRP3 Q96P20 3/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPK1 P28482 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MCHR1 Q99705 1/20 0.35

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
SCHEMBL8099968 0.89 MCHR1 (0.42) BRD4NLRP3CYP1A2CYP2C9CYP2C19
SCHEMBL8092437 0.86 ADRA2A (0.43) BRD4NLRP3CYP1A2CYP2C9CYP2C19
SCHEMBL8096734 0.85 PPARG (0.42) BRD4CYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL8092602 0.84 TRPM2 (0.40) BRD4CYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL6958447 0.84 SRC (0.40) SMN1; SMN2ALDH1A1MAPTMCHR1
SCHEMBL8091366 0.82 NOTUM (0.43) SMN1; SMN2ALDH1A1HSD17B10LMNAL3MBTL1
SCHEMBL7071372 0.79 PPARG (0.41) BRD4NLRP3CYP1A2CYP2C9CYP2C19
SCHEMBL27500544 0.75 HTR1A (0.34) MCHR1
SCHEMBL7309377 0.75 PLAU (0.47) SMN1; SMN2ALDH1A1LMNAMAPTMCHR1
SCHEMBL7308827 0.74 LMNA (0.47) SMN1; SMN2LMNAMAPTMCHR1

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-1183907-C Imidazoline compound, preparing process thereof and pharmaceutical composition contg. same SERVIER LAB (FR) 2005-01-12 CN disclosed
US-6127396-A Imidazoline compounds ADIR ET COMPAGNIE (FR) 2000-10-03 US disclosed