SCHEMBL17812690

SCHEMBL17812690

CC(C)CCCCCCCCCOC(=O)C1(C(=O)OCCCCCCCCCC(C)C)CC1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.36
ESR1 P03372 1/20 0.33
KDM4C Q9H3R0 2/20 0.33
KDM4A O75164 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
NAAA Q02083 1/20 0.32
ACHE P22303 1/20 0.32
BLM P54132 1/20 0.32
LMNA P02545 1/20 0.31
EPHX1 P07099 1/20 0.31
GBA2 Q9HCG7 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
PSEN1 P49768 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
SCHEMBL17812499 1.00 RARB (0.36) RARBESR1KDM4CKDM4APHF8
SCHEMBL17812703 1.00 RARB (0.36) RARBESR1KDM4CKDM4APHF8
SCHEMBL17812588 1.00 RARB (0.36) RARBESR1KDM4CKDM4APHF8
SCHEMBL17812615 1.00 RARB (0.36) RARBESR1KDM4CKDM4APHF8
SCHEMBL17812751 1.00 RARB (0.36) RARBESR1KDM4CKDM4APHF8
SCHEMBL17812597 1.00 RARB (0.36) RARBESR1KDM4CKDM4APHF8
SCHEMBL17812489 1.00 RARB (0.36) RARBESR1KDM4CKDM4APHF8
SCHEMBL17812708 1.00 RARB (0.36) RARBESR1KDM4CKDM4APHF8
SCHEMBL17812486 1.00 RARB (0.36) RARBESR1KDM4CKDM4APHF8
SCHEMBL17812591 0.93 ESR1 (0.34) RARBESR1KDM4CKDM4APHF8

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-9365715-B2 Thermoplastic elastomer composition and method for the production thereof STYROLUTION EUROPE GMBH (DE) 2016-06-14 US disclosed