SCHEMBL7056849

SCHEMBL7056849

Cc1ccc(C2CCCCO2)c(C)c1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 2/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
MDM2 Q00987 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PDE1C Q14123 2/20 0.32
PDE1B Q01064 1/20 0.32
HTR2C P28335 1/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
CFTR P13569 1/20 0.32
KCNH2 Q12809 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31

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
SCHEMBL15141549 0.76 HTR2C (0.42) SMN1; SMN2NPC1MDM2HTR2C
SCHEMBL21780613 0.75 KDM4E (0.44) HPGDLMNAPDE1CPDE1BHTR2C
SCHEMBL12822863 0.74 OPRL1 (0.33) PDE1CPDE1B
SCHEMBL23258722 0.73 MAP3K14 (0.35) POLBTSHRSMN1; SMN2MAPTHPGD
SCHEMBL28945295 0.73 PTGES2 (0.41) LMNA
SCHEMBL23250685 0.73 MAP3K14 (0.35) POLBTSHRSMN1; SMN2MAPTHPGD
SCHEMBL6390262 0.72 HTR2C (0.50) HTTSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL31401543 0.72 TSHR (0.52) POLBTSHRHTTSMN1; SMN2HPGD
SCHEMBL28344077 0.71 PRKAG1 (0.37) HPGDMEN1KMT2A
SCHEMBL17052374 0.71 HPGD (0.40) POLBSMN1; SMN2MAPTHPGDNPC1

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-2004106446-A1 PROTECTIVE COATING COMPOSITION LESCHENKO EVGENY EVGENIEVICH (RU) 2004-12-09 WO disclosed