SCHEMBL29948685

SCHEMBL29948685

CCCCCCCCCc1c(CC(CC)CCCC)cccc1P(=O)([O-])[O-].CCCCCCCCCc1c(CC(CC)CCCC)cccc1P(=O)([O-])[O-].CCCCCCCCCc1c(CC(CC)CCCC)cccc1P(=O)([O-])[O-].[Nd+3].[Nd+3]

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.34
GLA P06280 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
S1PR1 P21453 5/20 0.33
S1PR3 Q99500 5/20 0.33
S1PR2 O95136 4/20 0.33
S1PR4 O95977 4/20 0.33
BID P55957 3/20 0.33
MCL1 Q07820 3/20 0.33
BCL2L1 Q07817 2/20 0.33
BAK1 Q16611 2/20 0.33
KAT8 Q9H7Z6 2/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
EP300 Q09472 1/20 0.33
KAT2A Q92830 1/20 0.33

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
SCHEMBL30957271 0.86 S1PR1 (0.38) L3MBTL1GLATSHRHTTPRSS1
SCHEMBL30111983 0.83 PPARA (0.36) L3MBTL1GLATSHRHTTPRSS1
SCHEMBL4459974 0.76 TSHR (0.40) L3MBTL1GLATSHRHTTPRSS1
SCHEMBL23535414 0.76 LIPG (0.38) PRSS1PRSS2PRSS3S1PR1S1PR3
SCHEMBL29948813 0.76 LIPG (0.38) PRSS1PRSS2PRSS3S1PR1S1PR3
SCHEMBL29948795 0.75 NR1H2 (0.43) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL22289762 0.74 ALDH1A1 (0.41) L3MBTL1GLATSHRHTTPRSS1
SCHEMBL8981994 0.74 ALDH1A1 (0.43) L3MBTL1GLATSHRHTTPRSS1
Phosphoric Acid SCHEMBL15475373 0.74 TSHR (0.40) L3MBTL1GLATSHRHTTPRSS1
SCHEMBL9557544 0.73 LIPG (0.49) PRSS1PRSS2PRSS3BIDMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3883974-B1 POLYMER COMPOSITION AND A METHOD FOR PREPARING THEREOF SIBUR HOLDING PUBLIC JOINT STOCK CO (RU) 2025-09-03 EP disclosed
EP-4098667-B1 METHOD FOR PRODUCING MODIFIED POLYDIENES PUBLIC JOINT STOCK COMPANY SIBUR HOLDING PJSC SIBUR HOLDING (RU) 2025-03-12 EP disclosed
EP-4098667-A1 METHOD FOR PRODUCING MODIFIED POLYDIENES Public Joint Stock Company "Sibur Holding" (PJSC "Sibur Holding") (RU) 2022-12-07 EP disclosed
EP-4098666-A1 METHOD FOR PRODUCING MODIFIED POLYDIENES (VARIANTS) Public Joint Stock Company "Sibur Holding" (PJSC "Sibur Holding") (RU) 2022-12-07 EP disclosed
EP-4077410-A1 BRANCHED POLYDIENES, RUBBER COMPOSITIONS BASED ON THEREOF Public Joint Stock Company "Sibur Holding" (PJSC "Sibur Holding") (RU) 2022-10-26 EP disclosed