SCHEMBL10380231

SCHEMBL10380231

CCCCCCCCCCCCCCCC(O)C([C]=O)CCCCCCCCCCCCCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.50
CYP2D6 P10635 2/20 0.47
MAPT P10636 2/20 0.47
GMNN O75496 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
THPO P40225 1/20 0.47
MTOR P42345 1/20 0.47
BLM P54132 1/20 0.47
KDM4E B2RXH2 1/20 0.47
TP53 P04637 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CETP P11597 1/20 0.47
HTT P42858 1/20 0.47
UBE2N P61088 1/20 0.47
GPR84 Q9NQS5 7/20 0.45
FFAR1 O14842 2/20 0.45
FFAR4 Q5NUL3 1/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL10380788 1.00 SPHK1 (0.50) SPHK1CYP2D6MAPTGMNNLMNA
SCHEMBL7180270 0.90 GPR84 (0.44) SPHK1CYP2D6MAPTGMNNLMNA
SCHEMBL7366644 0.86 GPR84 (0.41) SPHK1CYP2D6MAPTGMNNLMNA
SCHEMBL19617794 0.83 ACE2 (0.40) SPHK1CYP2D6MAPTGMNNLMNA
SCHEMBL214294 0.78 MAPT (0.42) SPHK1MAPTLMNATP53GPR84
SCHEMBL8411270 0.78 MAPT (0.42) MAPTLMNAGPR84FFAR1
SCHEMBL4920628 0.78 SPHK1 (0.48) SPHK1CYP2D6MAPTGMNNLMNA
SCHEMBL3955215 0.77 SPHK1 (0.52) SPHK1CYP2D6MAPTGMNNLMNA
SCHEMBL3947308 0.77 SPHK1 (0.52) SPHK1CYP2D6MAPTGMNNLMNA
SCHEMBL10436066 0.77 MAPT (0.41) SPHK1MAPTLMNATP53GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1990006322-A1 PEPTIDOGLUCAN DIMERS, PROCESS FOR PRODUCING THEM AND THEIR USE AS IMMUNOMODULATORS HELOPHARM W. PETRIK GMBH & CO., KG (DE) 1990-06-14 WO disclosed