SCHEMBL9452017

SCHEMBL9452017

CCCCc1cc[c]c(-c2cccc(C(C)C)c2)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
PDE9A O76083 1/20 0.37
UCHL3 P15374 2/20 0.36
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
HSD11B1 P28845 1/20 0.34
PTPN5 P54829 1/20 0.34
LPL P06858 2/20 0.33
LIPG Q9Y5X9 2/20 0.33
PSMB5 P28074 1/20 0.33
APLNR P35414 1/20 0.33
JAK2 O60674 1/20 0.32
CASR P41180 1/20 0.32
PPARG P37231 1/20 0.32
SKP2 Q13309 1/20 0.32

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
SCHEMBL10454826 0.85 UCHL3 (0.46) UCHL3HSD11B1CASRSKP2
SCHEMBL1368971 0.81 HSD11B1 (0.46) HSD11B1PSMB5SKP2
SCHEMBL9753779 0.79 RXRA (0.44) CTSSCTSKRXRARXRBRXRG
SCHEMBL27535907 0.77 LPL (0.46) LPLLIPGSKP2
SCHEMBL15066937 0.77 SKP2 (0.44) LPLLIPGSKP2
SCHEMBL1936798 0.76 HSD11B1 (0.47) HSD11B1LPLLIPGPPARG
SCHEMBL2722607 0.74 HSD11B1 (0.44) HSD11B1LPLLIPG
SCHEMBL27657598 0.73 LPL (0.53) LPLLIPGPPARG
SCHEMBL4458305 0.73 NPC1 (0.47) HSD11B1SKP2
SCHEMBL27699506 0.73 SMN1; SMN2 (0.43) HSD11B1SKP2

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
EP-0550817-A2 Thermal transfer sheet DAI NIPPON PRINTING CO., LTD. (JP) 1993-07-14 EP disclosed