SCHEMBL5488771

SCHEMBL5488771

CCCCCCCCCCCCCC(Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)C(=O)S

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 2/20 0.45
GAA P10253 5/20 0.42
KMT2A Q03164 4/20 0.42
ALDH1A1 P00352 4/20 0.39
TSHR P16473 3/20 0.39
ATM Q13315 3/20 0.39
NPSR1 Q6W5P4 3/20 0.39
MEN1 O00255 3/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
MAPK1 P28482 2/20 0.39
BLM P54132 2/20 0.39
HIF1A Q16665 2/20 0.39
MAPT P10636 2/20 0.39
USP2 O75604 1/20 0.39
CYP2D6 P10635 1/20 0.39
LMNA P02545 3/20 0.39
RECQL P46063 1/20 0.38
XBP1 P17861 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL18662878 0.88 HMGCR (0.46) HMGCRGAAKMT2AALDH1A1TSHR
SCHEMBL284122 0.88 HMGCR (0.46) HMGCRGAAKMT2AALDH1A1TSHR
SCHEMBL8954906 0.88 HMGCR (0.46) HMGCRGAAKMT2AALDH1A1TSHR
SCHEMBL11459320 0.88 HMGCR (0.46) HMGCRGAAKMT2AALDH1A1TSHR
SCHEMBL21616894 0.88 HMGCR (0.46) HMGCRGAAKMT2AALDH1A1TSHR
SCHEMBL17491249 0.88 HMGCR (0.46) HMGCRGAAKMT2AALDH1A1TSHR
SCHEMBL5415838 0.88 HMGCR (0.46) HMGCRGAAKMT2AALDH1A1TSHR
SCHEMBL208069 0.88 HMGCR (0.46) HMGCRGAAKMT2AALDH1A1TSHR
SCHEMBL18855 0.88 HMGCR (0.46) HMGCRGAAKMT2AALDH1A1TSHR
SCHEMBL992238 0.88 HMGCR (0.46) HMGCRGAAKMT2AALDH1A1TSHR

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-20070191534-A1 Conductive material mixed composition ADEKA CORPORATION (JP) 2007-08-16 US disclosed