SCHEMBL14357779

SCHEMBL14357779

CC(CCC(=O)O)C1CCC2C3CCC4CC(O)CCC4(C)C3CC(OC(=O)CCC(=O)OCC(=O)OC(C)(C)C)C12C

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPBAR1 Q8TDU6 6/20 0.63
▸ NR1H4 Q96RI1 2/20 0.63
▸ TBXA2R P21731 1/20 0.63
▸ SLC10A2 Q12908 1/20 0.63
▸ PDE3A Q14432 1/20 0.63
▸ CASP7 P55210 3/20 0.58
▸ MAPK1 P28482 3/20 0.58
▸ MAPT P10636 3/20 0.58
▸ TP53 P04637 2/20 0.58
▸ HSD17B10 Q99714 2/20 0.58
▸ BLM P54132 2/20 0.58
▸ TDP1 Q9NUW8 2/20 0.58
▸ USP2 O75604 2/20 0.58
▸ LMNA P02545 2/20 0.58
▸ VDR P11473 2/20 0.58
▸ HIF1A Q16665 2/20 0.58
▸ MDM4 O15151 1/20 0.58
▸ CYP3A4 P08684 1/20 0.58
▸ HSPD1 P10809 1/20 0.58
▸ TSHR P16473 1/20 0.58

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
SCHEMBL14357794 0.96 MAPT (0.61) GPBAR1NR1H4TBXA2RSLC10A2PDE3A
SCHEMBL14357781 0.93 VDR (0.56) GPBAR1NR1H4TBXA2RSLC10A2PDE3A
SCHEMBL14388478 0.92 GPBAR1 (0.66) GPBAR1NR1H4TBXA2RSLC10A2PDE3A
SCHEMBL14357819 0.89 GPBAR1 (0.56) GPBAR1NR1H4SLC10A2PDE3ATDP1
SCHEMBL14357808 0.89 GPBAR1 (0.64) GPBAR1NR1H4SLC10A2PDE3ATDP1
SCHEMBL14357803 0.89 MAPT (0.51) GPBAR1NR1H4TBXA2RSLC10A2PDE3A
SCHEMBL14388466 0.88 USP2 (0.71) GPBAR1NR1H4TBXA2RSLC10A2PDE3A
SCHEMBL8736223 0.87 MAPT (0.75) GPBAR1NR1H4TBXA2RSLC10A2PDE3A
SCHEMBL16343769 0.87 MAPT (0.75) GPBAR1NR1H4TBXA2RSLC10A2PDE3A
SCHEMBL17320288 0.87 MAPT (0.75) GPBAR1NR1H4TBXA2RSLC10A2PDE3A

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-20070254247-A1 Radiation-sensitive resin composition YAMAMOTO MASAFUMI 2007-11-01 — — US disclosed
Send feedback