SCHEMBL9257311

SCHEMBL9257311

Cc1cc(C)nc(NC(=O)C2=COc3cc(O)c(C(C)(C)C)cc3O2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.42
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA4 P43681 1/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 2/20 0.39
SORT1 Q99523 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
SMN1; SMN2 Q16637 5/20 0.36
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
KMT2A Q03164 3/20 0.36
MAPK1 P28482 3/20 0.36
ALDH1A1 P00352 4/20 0.35
GBA1 P04062 1/20 0.35
MEN1 O00255 2/20 0.34
KDM4E B2RXH2 2/20 0.34
HPGD P15428 2/20 0.34

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
SCHEMBL9259716 0.80 LCK (0.45) LCKCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL9261637 0.74 ALOX15 (0.41) LMNAMAPTCYP1A2CYP3A4SMN1; SMN2
SCHEMBL9259471 0.74 ALOX15 (0.41) LMNAMAPTCYP1A2CYP3A4SMN1; SMN2
SCHEMBL9258671 0.71 SMN1; SMN2 (0.38) MAPTCYP1A2CYP3A4SMN1; SMN2KMT2A
SCHEMBL9259996 0.67 HSP90AA1 (0.41) MAPTCYP1A2SMN1; SMN2KMT2AALDH1A1
SCHEMBL12189258 0.66 LCK (0.55) LCKCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL9260914 0.66 HSP90AA1 (0.41) LMNAMAPTCYP1A2CYP3A4SMN1; SMN2
SCHEMBL9259063 0.66 HSP90AA1 (0.41) LMNAMAPTCYP1A2CYP3A4SMN1; SMN2
SCHEMBL14097068 0.65 LCK (0.66) LCKCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL9255559 0.65 MAPT (0.40) MAPTNPC1RAB9AKMT2AMEN1

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
US-5439909-A 2-Substituted with amide or thioamide group; antioxidant for lipoproteins, antilipemic agents, anticholesterol agents ADIR ET COMPAGNIE (FR) 1995-08-08 US disclosed
US-5420132-A Antilipemic agents ADIR ET COMPAGNIE (FR) 1995-05-30 US disclosed