SCHEMBL30501522

SCHEMBL30501522

CC(=O)C(Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1.CC(=O)C(Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1.CC(=O)C(Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1.[Pd].[Pd]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.50
HIF1A Q16665 1/20 0.50
LMNA P02545 2/20 0.48
ALDH1A1 P00352 4/20 0.47
SLC6A2 P23975 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45
FDPS P14324 1/20 0.44
RECQL P46063 2/20 0.44
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
CES1 P23141 2/20 0.43
CES2 O00748 1/20 0.43
AKR1B1 P15121 1/20 0.43
CYP2D6 P10635 1/20 0.42
TRPA1 O75762 1/20 0.41
MMP8 P22894 2/20 0.41
ALPI P09923 1/20 0.41
PKM P14618 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
SCHEMBL28870003 1.00 SMN1; SMN2 (0.50) SMN1; SMN2HIF1ALMNAALDH1A1SLC6A2
SCHEMBL30631675 1.00 SMN1; SMN2 (0.50) SMN1; SMN2HIF1ALMNAALDH1A1SLC6A2
SCHEMBL27627632 1.00 SMN1; SMN2 (0.50) SMN1; SMN2HIF1ALMNAALDH1A1SLC6A2
SCHEMBL28037957 0.98 SMN1; SMN2 (0.52) SMN1; SMN2HIF1ALMNAALDH1A1SLC6A2
SCHEMBL28650402 0.96 SMN1; SMN2 (0.50) SMN1; SMN2HIF1ALMNAALDH1A1SLC6A2
SCHEMBL28663883 0.96 SMN1; SMN2 (0.50) SMN1; SMN2HIF1ALMNAALDH1A1SLC6A2
SCHEMBL27674017 0.88 SMN1; SMN2 (0.47) SMN1; SMN2HIF1ALMNAALDH1A1SLC6A2
SCHEMBL9806342 0.79 MMP1 (0.46) ALDH1A1PKM
SCHEMBL7761470 0.79 MMP1 (0.46) ALDH1A1PKM
SCHEMBL14518081 0.78 SMN1; SMN2 (0.50) SMN1; SMN2HIF1ALMNAALDH1A1SLC6A2

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
CN-116490511-A Resin composition, coated dried product, melt-kneaded product, optical filter, image display device, solid-state imaging element, squaraine compound, and method for producing same 富士胶片株式会社 2023-07-25 CN disclosed