SCHEMBL7096129

SCHEMBL7096129

CON(C)c1ccc2c(c1)CCC2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
ALDH1A1 P00352 6/20 0.38
NPC1 O15118 2/20 0.36
POLB P06746 2/20 0.36
RAB9A P51151 2/20 0.36
NOX4 Q9NPH5 1/20 0.35
NOX1 Q9Y5S8 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
MAPT P10636 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
RAPGEF4 Q8WZA2 1/20 0.34
DRD2 P14416 1/20 0.34
DRD1 P21728 1/20 0.34

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
SCHEMBL1254154 0.79 RXRA (0.47) RXRARXRBRXRGALDH1A1NPC1
Hydrochloric Acid SCHEMBL2864663 0.78 RXRA (0.46) RXRARXRBRXRGALDH1A1NOX4
SCHEMBL15466082 0.75 RXRA (0.47) RXRARXRBRXRGALDH1A1NPC1
SCHEMBL22681835 0.75 ALDH1A1 (0.50) ALDH1A1NPC1POLBRAB9AMAPT
SCHEMBL2091407 0.74 RXRA (0.48) RXRARXRBRXRGALDH1A1NPC1
SCHEMBL9058750 0.74 RXRA (0.45) RXRARXRBRXRGALDH1A1NPC1
SCHEMBL22681798 0.73 RXRA (0.43) RXRARXRBRXRGALDH1A1NPC1
SCHEMBL22681601 0.72 RXRA (0.46) RXRARXRBRXRGALDH1A1NPC1
SCHEMBL22681817 0.72 ALDH1A1 (0.46) RXRARXRBRXRGALDH1A1NPC1
SCHEMBL22744651 0.72 MTNR1A (0.50) ALDH1A1NPC1RAB9AMAPTDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0966435-A4 AMINOINDAN DERIVATIVES TEVA PHARMA (IL) 2003-04-16 EP disclosed
EP-0966435-A1 AMINOINDAN DERIVATIVES TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 1999-12-29 EP disclosed
WO-1998027055-A1 AMINOINDAN DERIVATIVES TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 1998-06-25 WO disclosed