SCHEMBL19853034

SCHEMBL19853034

CC(C)=CCCC(C)C1CCC2C3CC=C4C(C)(C)C(OC(=O)c5cc(N)cc(N)c5)CCC4(C)C3CC[C@]12C

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.55
PTPN1 P18031 7/20 0.46
NR1H3 Q13133 7/20 0.44
EPHA2 P29317 1/20 0.44
PTPN2 P17706 2/20 0.43
OSBP P22059 2/20 0.43
GRIN1 Q05586 2/20 0.43
GRIN2A Q12879 2/20 0.43
GRIN2B Q13224 2/20 0.43
OSBP2 Q969R2 1/20 0.43
DHCR24 Q15392 1/20 0.42
NPC1L1 Q9UHC9 1/20 0.42

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
SCHEMBL9999687 1.00 RORC (0.55) RORCPTPN1NR1H3EPHA2PTPN2
SCHEMBL12172528 0.96 RORC (0.50) RORCPTPN1NR1H3EPHA2OSBP
SCHEMBL14431387 0.92 RORC (0.48) RORCPTPN1NR1H3EPHA2OSBP
SCHEMBL9999571 0.89 OSBP (0.53) RORCPTPN1NR1H3PTPN2OSBP
SCHEMBL106036 0.88 RORC (0.58) RORCPTPN1NR1H3EPHA2OSBP
SCHEMBL2608105 0.85 RORC (0.66) RORCPTPN1NR1H3EPHA2OSBP
SCHEMBL105665 0.85 RORC (0.55) RORCPTPN1NR1H3EPHA2PTPN2
SCHEMBL15501491 0.85 USP2 (0.41) RORCNR1H3
SCHEMBL15004641 0.84 RORC (0.66) RORCPTPN1NR1H3EPHA2OSBP
SCHEMBL16265112 0.84 RORC (0.58) RORCPTPN1NR1H3EPHA2OSBP

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-2018025872-A1 LIQUID CRYSTAL DISPLAY ELEMENT EQUIPPED WITH LIQUID CRYSTAL PANEL HAVING CURVED SURFACE AND LIQUID CRYSTAL ALIGNING AGENT FOR SAME 日産化学工業株式会社 2018-02-08 WO disclosed