SCHEMBL6204741

SCHEMBL6204741

COC(O)c1cccc(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.50
ACP3 P15309 1/20 0.43
SLC6A4 P31645 3/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A3 Q01959 1/20 0.40
TSHR P16473 1/20 0.40
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
SLC2A1 P11166 2/20 0.40

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
SCHEMBL19027642 0.82 ACP3 (0.44) AOC3ACP3SLC6A4SLC6A2TSHR
SCHEMBL6203322 0.79 AOC3 (0.53) AOC3ACP3SLC6A4SLC6A2SLC6A3
SCHEMBL23956426 0.79 SLC6A4 (0.44) AOC3ACP3SLC6A4SLC6A2SLC6A3
SCHEMBL6205146 0.79 CNR2 (0.39) AOC3TSHR
SCHEMBL3096347 0.78 AOC3 (0.56) AOC3ACP3SLC6A4SLC6A2SLC6A3
SCHEMBL6201854 0.78 AOC3 (0.49) AOC3ACP3
SCHEMBL13140614 0.78 HDAC4 (0.47) AOC3TSHRADRB1
SCHEMBL28582936 0.78 CYP3A4 (0.47) AOC3SLC6A4SLC6A2SLC6A3
SCHEMBL6204449 0.78 ADRB1 (0.53) SLC6A3TSHRADRB2ADRB1ADRB3
SCHEMBL11395224 0.78 AOC3 (0.51) AOC3ACP3SLC6A4SLC6A2SLC6A3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506175-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2005-02-16 EP disclosed
WO-2003097609-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDFG RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2003-11-27 WO disclosed