SCHEMBL6570906

SCHEMBL6570906

CC(C)CCCC1CCC(O)CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.42
SHBG P04278 1/20 0.35
GBA1 P04062 2/20 0.35
CYP1A2 P05177 1/20 0.32
LMNA P02545 2/20 0.32
EBP Q15125 2/20 0.32
CDC25A P30304 1/20 0.32
CDC25B P30305 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
TP53 P04637 1/20 0.30
LNPEP Q9UIQ6 1/20 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
SCHEMBL876348 0.89
SCHEMBL1154068 0.86 SHBG (0.38) MAPTSHBGGBA1
SCHEMBL1153977 0.86 SHBG (0.38) MAPTSHBGGBA1
SCHEMBL1153349 0.86 SHBG (0.38) MAPTSHBGGBA1
SCHEMBL4390670 0.84 LMNA (0.46) MAPTSHBGGBA1LMNAEBP
SCHEMBL23945113 0.83 MAPT (0.42) MAPTGBA1CYP1A2LMNACDC25A
SCHEMBL9379793 0.79 CYP1A2 (0.52) MAPTCYP1A2LMNA
SCHEMBL28414746 0.79 LMNA (0.42) MAPTGBA1CYP1A2LMNAMAPK1
SCHEMBL12981938 0.79 CYP1A2 (0.46) MAPTCYP1A2LMNA
SCHEMBL18360766 0.79 MAPT (0.55) MAPTSHBGCYP1A2LMNAMAPK1

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
EP-1004654-B1 Adjuvants and methods for raising intracellular calcium ion concentration TAKASAGO PERFUMERY CO LTD (JP) 2004-04-14 EP disclosed
EP-1004654-A2 Adjuvants and methods for raising intracellular calcium ion concentration Takasago International Corporation (JP) 2000-05-31 EP disclosed