SCHEMBL28568595

SCHEMBL28568595

C1CCC(C2CC2)C1.C=C(C)C(=O)OC

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
TSHR P16473 1/20 0.36
EPHX1 P07099 1/20 0.34
NPSR1 Q6W5P4 1/20 0.32
HCRTR2 O43614 1/20 0.31
THRB P10828 1/20 0.31
CCR1 P32246 1/20 0.30
CCR2 P41597 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
EPHX2 P34913 1/20 0.30

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
SCHEMBL20530993 0.82 ALDH1A1 (0.83) ALDH1A1TSHREPHX1NPSR1THRB
Cyclohexane SCHEMBL15844071 0.82 ALDH1A1 (0.83) ALDH1A1TSHREPHX1NPSR1THRB
SCHEMBL8408211 0.82 ALDH1A1 (0.83) ALDH1A1TSHREPHX1NPSR1THRB
SCHEMBL5432413 0.82 ALDH1A1 (0.83) ALDH1A1TSHREPHX1NPSR1THRB
Cyclohexane SCHEMBL489150 0.82 ALDH1A1 (0.83) ALDH1A1TSHREPHX1NPSR1THRB
SCHEMBL3685691 0.80 ALDH1A1 (0.58) ALDH1A1TSHREPHX1NPSR1
SCHEMBL29253577 0.80 ALDH1A1 (0.58) ALDH1A1TSHREPHX1NPSR1SMN1; SMN2
SCHEMBL6854437 0.80 ALDH1A1 (0.58) ALDH1A1TSHR
Cyclohexane SCHEMBL6697980 0.80 ALDH1A1 (0.79) ALDH1A1TSHREPHX1THRB
SCHEMBL10636466 0.79

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-112980542-A High viscosity index comb polymer viscosity modifiers and methods of using the same to modify lubricant viscosity 英菲诺姆国际有限公司 2021-06-18 CN disclosed