SCHEMBL9311518

SCHEMBL9311518

CC=C[C@H]1CC[C@H](c2ccc(-c3ccc(Cl)cc3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.41
SLC2A1 P11166 1/20 0.39
SLC18A3 Q16572 1/20 0.39
HTR3A P46098 1/20 0.39
LSS P48449 1/20 0.37
HDAC2 Q92769 1/20 0.37
SRD5A1 P18405 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MAP1LC3B Q9GZQ8 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL9311512 1.00 DRD2 (0.41) DRD2SLC2A1SLC18A3HTR3ALSS
SCHEMBL8379736 1.00 DRD2 (0.41) DRD2SLC2A1SLC18A3HTR3ALSS
SCHEMBL8379741 1.00 DRD2 (0.41) DRD2SLC2A1SLC18A3HTR3ALSS
SCHEMBL8034489 0.95 DRD2 (0.39) DRD2SLC2A1SLC18A3HTR3ALSS
SCHEMBL9617266 0.90 DRD2 (0.41) DRD2SLC2A1SLC18A3HTR3ALSS
SCHEMBL9179061 0.90 DRD2 (0.41) DRD2SLC2A1SLC18A3HTR3ALSS
SCHEMBL9179048 0.90 DRD2 (0.41) DRD2SLC2A1SLC18A3HTR3ALSS
SCHEMBL9617265 0.90 DRD2 (0.41) DRD2SLC2A1SLC18A3HTR3ALSS
SCHEMBL9179054 0.90 DRD2 (0.41) DRD2SLC2A1SLC18A3HTR3ALSS
SCHEMBL13557301 0.90 DRD2 (0.41) DRD2SLC2A1SLC18A3HTR3ALSS

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-5292452-A Electrooptical devices; high dielectric anisotropy, low rotation viscosity, short response time HOFFMANN-LA ROCHE INC. (US) 1994-03-08 US disclosed