SCHEMBL28599147

SCHEMBL28599147

CC1(C)OB(c2cc(Cl)cc(I)c2)OC1(C)C

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LPL P06858 13/20 0.38
LIPG Q9Y5X9 13/20 0.38
EGFR P00533 2/20 0.33
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA9 Q16790 3/20 0.33
CA12 O43570 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
F11 P03951 1/20 0.32
P2RX7 Q99572 1/20 0.31

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
SCHEMBL587884 0.86 LPL (0.44) LPLLIPGEGFRCA1CA2
SCHEMBL25815214 0.86 LIPG (0.44) LPLLIPGCA1CA2CA9
SCHEMBL18015340 0.86 LPL (0.44) LPLLIPGEGFRCA1CA2
SCHEMBL16555162 0.79 LPL (0.39) LPLLIPGCA1CA2CA9
SCHEMBL22179707 0.79 LPL (0.39) LPLLIPGEGFRCA1CA2
SCHEMBL7887164 0.78 LPL (0.49) LPLLIPGEGFRCA1CA2
SCHEMBL4244671 0.78 LPL (0.38) LPLLIPGEGFRCA1CA2
SCHEMBL30345418 0.78 TP53 (0.43) LPLLIPGEGFRCA1CA2
SCHEMBL1494499 0.78 TP53 (0.43) LPLLIPGEGFRCA1CA2
SCHEMBL29925307 0.78 LPL (0.38) LPLLIPGEGFRCA1CA2

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-113121553-B Organic compound, electronic element containing organic compound and electronic device 陕西莱特光电材料股份有限公司 2023-04-07 CN disclosed
CN-113121553-A Organic compound, electronic element containing organic compound and electronic device 陕西莱特光电材料股份有限公司 2021-07-16 CN disclosed