SCHEMBL5851005

SCHEMBL5851005

CCC(C)(CO)C(O)CCCCCCCC(O)C(C)(CC)CO

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
TSHR P16473 1/20 0.33
CYP2D6 P10635 2/20 0.32
SPHK1 Q9NYA1 2/20 0.32
GMNN O75496 1/20 0.32
POLB P06746 1/20 0.32
THPO P40225 1/20 0.32
MTOR P42345 1/20 0.32
BLM P54132 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
CETP P11597 1/20 0.32
HTT P42858 1/20 0.32
UBE2N P61088 1/20 0.32
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
GPR84 Q9NQS5 3/20 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
SCHEMBL7248980 0.78 TSHR (0.50) TSHR
SCHEMBL9345924 0.77 LMNA (0.39) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL11701299 0.74 CETP (0.39) TSHRCETP
SCHEMBL11904298 0.74 ALDH1A1 (0.35) LMNATSHRCYP2D6SPHK1GMNN
SCHEMBL3042894 0.73 TSHR (0.38) TSHR
SCHEMBL28281226 0.73 GPR84 (0.39) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL159861 0.72
SCHEMBL6812423 0.71 LMNA (0.46) LMNATSHRCYP2D6SPHK1GMNN
SCHEMBL7159926 0.71 LMNA (0.46) LMNATSHRCYP2D6SPHK1GMNN
SCHEMBL8366584 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7056559-B2 Ink-jet image forming method KONICA CORPORATION (JP) 2006-06-06 US disclosed
US-20040050292-A1 Ink-jet image forming method KONICA CORPORATION (JP) 2004-03-18 US disclosed