SCHEMBL30786391

SCHEMBL30786391

C=C(C)c1cccc(C(=C)C)c1.CC(C)(C)OOC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
TSHR P16473 3/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 2/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL545215 0.86 L3MBTL1 (0.44) ALDH1A1TSHRL3MBTL1HTTMAPT
SCHEMBL167439 0.84 FURIN (0.43) TSHRTDP1L3MBTL1HTTMAPT
SCHEMBL17421702 0.82 FURIN (0.41) ALDH1A1TSHRTDP1L3MBTL1HTT
SCHEMBL30834584 0.82 FURIN (0.41) ALDH1A1TSHRTDP1L3MBTL1HTT
SCHEMBL6252421 0.82 FURIN (0.41) ALDH1A1TSHRTDP1L3MBTL1HTT
SCHEMBL13026719 0.80 SLC7A5 (0.54) ALDH1A1TSHRHSD17B10TDP1L3MBTL1
SCHEMBL1707006 0.79 L3MBTL1 (0.47) ALDH1A1TSHRL3MBTL1HTTMAPT
SCHEMBL3190603 0.79 NPC1 (0.41) ALDH1A1TSHRL3MBTL1HTTMAPT
SCHEMBL12449051 0.78 FURIN (0.36) ALDH1A1TSHRTDP1L3MBTL1HTT
SCHEMBL1536276 0.78 FURIN (0.39) TSHRHSD17B10TDP1L3MBTL1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119256051-A Silicon phenylene Polymer 瓦克化学股份公司 2025-01-03 CN disclosed
CN-118742592-A Polymer with organic polymer organosiloxane copolymers 瓦克化学股份公司 2024-10-01 CN disclosed
CN-117794982-A Composition containing polyorganosiloxane having polyphenylene ether group 瓦克化学股份公司 2024-03-29 CN disclosed
CN-117651641-A Metal-plated laminates containing polyorganosiloxanes 瓦克化学股份公司 2024-03-05 CN disclosed