SCHEMBL9627973

SCHEMBL9627973

CCCC=CC1CCC(C2CCC(c3ccc(Cl)cc3)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.38
LSS P48449 1/20 0.36
SLC2A1 P11166 1/20 0.35
SLC18A3 Q16572 1/20 0.35
HTR3A P46098 1/20 0.34
HDAC2 Q92769 1/20 0.33
SRD5A1 P18405 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
SLC6A3 Q01959 1/20 0.33
CCR1 P32246 1/20 0.32
MAPT P10636 2/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 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
SCHEMBL9181480 1.00 DRD2 (0.47) DRD2L3MBTL1LSSSLC2A1SLC18A3
SCHEMBL9627978 1.00 DRD2 (0.47) DRD2L3MBTL1LSSSLC2A1SLC18A3
SCHEMBL9181463 1.00 DRD2 (0.47) DRD2L3MBTL1LSSSLC2A1SLC18A3
SCHEMBL9312788 0.91 DRD2 (0.47) DRD2L3MBTL1LSSSLC2A1SLC18A3
SCHEMBL8379888 0.91 DRD2 (0.47) DRD2L3MBTL1LSSSLC2A1SLC18A3
SCHEMBL8379890 0.91 DRD2 (0.47) DRD2L3MBTL1LSSSLC2A1SLC18A3
SCHEMBL9312793 0.91 DRD2 (0.47) DRD2L3MBTL1LSSSLC2A1SLC18A3
SCHEMBL8518725 0.89 DRD2 (0.44) DRD2L3MBTL1LSSSLC2A1SLC18A3
SCHEMBL8518723 0.89 DRD2 (0.44) DRD2L3MBTL1LSSSLC2A1SLC18A3
SCHEMBL8518719 0.89 DRD2 (0.44) DRD2L3MBTL1LSSSLC2A1SLC18A3

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-5174921-A BICYCLOHEXYL DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 1992-12-29 US disclosed