SCHEMBL7784750

SCHEMBL7784750

C=CCC(O)(CO)C(O)CCCCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
SPHK1 Q9NYA1 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
CETP P11597 1/20 0.37
HTT P42858 1/20 0.37
UBE2N P61088 1/20 0.37
GPR84 Q9NQS5 7/20 0.33
TRPA1 O75762 1/20 0.33
DDAH1 O94760 1/20 0.33
GAPDH P04406 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
SCHEMBL8637903 0.81 CYP2D6 (0.38) CYP2D6LMNAMAPTSPHK1GMNN
SCHEMBL4436955 0.80 TSHR (0.47) CYP2D6LMNAMAPTSPHK1GMNN
SCHEMBL132574 0.78 LMNA (0.39) CYP2D6LMNAMAPTSPHK1GMNN
SCHEMBL3690415 0.78 LMNA (0.43) CYP2D6LMNAMAPTSPHK1GMNN
SCHEMBL8682114 0.77 LMNA (0.42) CYP2D6LMNAMAPTSPHK1GMNN
SCHEMBL3394794 0.77 LMNA (0.42) CYP2D6LMNAMAPTSPHK1GMNN
SCHEMBL1147850 0.77 LMNA (0.42) CYP2D6LMNAMAPTSPHK1GMNN
SCHEMBL1147732 0.77 LMNA (0.42) CYP2D6LMNAMAPTSPHK1GMNN
SCHEMBL4875812 0.77 LMNA (0.42) CYP2D6LMNAMAPTSPHK1GMNN
SCHEMBL1147869 0.77 LMNA (0.42) CYP2D6LMNAMAPTSPHK1GMNN

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
US-6252060-B1 COMPLEX CONTAINING DIDEOXYGUANOSINE NEXSTAR PHARMACEUTICALS, INC. 2001-06-26 US claimed