SCHEMBL10564355

SCHEMBL10564355

C=CC[C@@](O)(C(O)CCCCCCCCCCCCCCCCCC)[C@@H](O)[C@H](O)[C@@](O)(CC=C)C(O)CCCCCCCCCCCCCCCCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.37
CYP2D6 P10635 2/20 0.37
SPHK1 Q9NYA1 2/20 0.37
LMNA P02545 2/20 0.37
GMNN O75496 1/20 0.37
POLB P06746 1/20 0.37
THPO P40225 1/20 0.37
MTOR P42345 1/20 0.37
BLM P54132 1/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
CETP P11597 1/20 0.37
HTT P42858 1/20 0.37
UBE2N P61088 1/20 0.37
TSHR P16473 1/20 0.36
FFAR1 O14842 1/20 0.35
FDPS P14324 1/20 0.35

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
SCHEMBL7719373 0.78 GPR84 (0.39) GPR84CYP2D6SPHK1LMNAGMNN
SCHEMBL10565923 0.78 GPR84 (0.39) GPR84CYP2D6SPHK1LMNAGMNN
SCHEMBL7722113 0.78 GPR84 (0.39) GPR84CYP2D6SPHK1LMNAGMNN
SCHEMBL10564052 0.78 GPR84 (0.39) GPR84CYP2D6SPHK1LMNAGMNN
SCHEMBL10563882 0.78 GPR84 (0.39) GPR84CYP2D6SPHK1LMNAGMNN
SCHEMBL10564767 0.78 GPR84 (0.39) GPR84CYP2D6SPHK1LMNAGMNN
SCHEMBL10564298 0.78 GPR84 (0.39) GPR84CYP2D6SPHK1LMNAGMNN
SCHEMBL10564970 0.78 GPR84 (0.39) GPR84CYP2D6SPHK1LMNAGMNN
SCHEMBL10563168 0.78 GPR84 (0.39) GPR84CYP2D6SPHK1LMNAGMNN
SCHEMBL10564927 0.78 GPR84 (0.39) GPR84CYP2D6SPHK1LMNAGMNN

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
US-4804789-A D-mannite derivatives as starting products for the synthesis of phospholipids MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 1989-02-14 US claimed
EP-0116566-B1 NEW D-MANNITE DERIVATIVES AS STARTING PRODUCTS FOR THE SYNTHESIS OF PHOSPHOLIPIDS Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1988-06-08 EP claimed
US-4804789-A D-mannite derivatives as starting products for the synthesis of phospholipids MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 1989-02-14 US disclosed
US-4734225-A ANTITUMOR AGENTS MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 1988-03-29 US disclosed