SCHEMBL6902476

SCHEMBL6902476

C=CC1c2ccccc2-c2ccccc21.[PoH2]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.44
HTR2A P28223 1/20 0.39
POLB P06746 2/20 0.38
ACHE P22303 3/20 0.36
ADRA1A P35348 2/20 0.36
CHRM2 P08172 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA2A P08913 1/20 0.36
CHRM1 P11229 1/20 0.36
DRD1 P21728 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
OPRM1 P35372 1/20 0.36
DRD3 P35462 1/20 0.36
SLC6A3 Q01959 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
KMT2A Q03164 2/20 0.35
BCHE P06276 2/20 0.35
SLC22A2 O15244 1/20 0.35
SLC22A3 O75751 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
SCHEMBL1568290 0.97 GPR3 (0.46) GPR3HTR2APOLBACHEADRA1A
SCHEMBL3799589 0.81 HTR2A (0.41) GPR3HTR2AACHEADRA1ACHRM2
SCHEMBL1306761 0.78 GPR3 (0.38) GPR3HTR2APOLBACHEADRA1A
SCHEMBL1766205 0.77 GPR3 (0.46) GPR3HTR2APOLBACHEADRA1A
SCHEMBL158938 0.76 ALDH1A1 (0.35) GPR3HTR2A
SCHEMBL6421466 0.76 GPR3 (0.44) GPR3HTR2APOLBACHEADRA1A
SCHEMBL31494254 0.74
SCHEMBL18557613 0.73
SCHEMBL3068122 0.73 MAOA (0.38) HTR2APOLBACHEADRA1ACHRM2
SCHEMBL1766128 0.72 GPR3 (0.41) GPR3HTR2APOLBACHEADRA1A

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-20040265548-A1 Nanopatterned templates from oriented degradable diblock copolymer thin films INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2004-12-30 US claimed