SCHEMBL4582266

SCHEMBL4582266

CCCCc1cc(C)cc(CCCC)c1OC(c1c(CCCC)cc(C)cc1CCCC)C(CO)(CO)COP(=O)(O)OP(=O)(O)O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 12/20 0.34
S1PR3 Q99500 8/20 0.34
S1PR4 O95977 3/20 0.30
S1PR5 Q9H228 3/20 0.30
S1PR2 O95136 2/20 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
Pyrophosphoric Acid SCHEMBL4582270 0.90 S1PR1 (0.33) S1PR1S1PR3S1PR4S1PR2
SCHEMBL5014498 0.82 ALDH1A1 (0.33)
SCHEMBL2361227 0.79 KDM4E (0.31)
SCHEMBL17255561 0.79 CNR1 (0.31) S1PR1S1PR3S1PR4S1PR5S1PR2
SCHEMBL472658 0.77 BTN3A1 (0.31)
SCHEMBL2361226 0.77
SCHEMBL5013004 0.75 PPARG (0.34)
SCHEMBL472730 0.73 S1PR1 (0.41) S1PR1S1PR3S1PR4S1PR5S1PR2
SCHEMBL28878389 0.73 NPC1 (0.35) S1PR1S1PR3S1PR4S1PR5S1PR2
SCHEMBL6834313 0.72 S1PR1 (0.34) S1PR1S1PR3S1PR4S1PR5S1PR2

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
EP-0955087-B1 Gas adsorption sheet and air-purifying filter TOYO BOSEKI (JP) 2008-12-24 EP disclosed
US-6746760-B2 Gas adsorption sheet and air-purifying filter TOYOBO CO., LTD (JP) 2004-06-08 US disclosed
US-20030207635-A1 Gas adsorption sheet and air-purifying filter MINEMURA SHINICHI (JP) 2003-11-06 US disclosed
EP-0955087-A1 Gas adsorption sheet and air-purifying filter TOYOBO CO., LTD. (JP) 1999-11-10 EP disclosed