SCHEMBL7674635

SCHEMBL7674635

CCN(CC)c1ccccc1C[O]

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.46
TSHR P16473 2/20 0.36
TPH1 P17752 1/20 0.34
ALDH1A3 P47895 2/20 0.34
MEN1 O00255 2/20 0.34
RAB9A P51151 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 1/20 0.34
NOX1 Q9Y5S8 1/20 0.34
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
GABRA1 P14867 2/20 0.33
GABRB2 P47870 2/20 0.33
CNR2 P34972 1/20 0.33
NR3C1 P04150 1/20 0.33
PGR P06401 1/20 0.33
GAA P10253 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALDH3A1 P30838 1/20 0.33

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
SCHEMBL462452 0.86 AR (0.49) ARTSHRTPH1ALDH1A3MEN1
Hydrochloric Acid SCHEMBL31500442 0.84 AR (0.47) ARTSHRTPH1ALDH1A3MEN1
Hydrochloric Acid SCHEMBL5510044 0.84 AR (0.47) ARTSHRTPH1ALDH1A3MEN1
SCHEMBL1241839 0.82 AR (0.53) ARTSHRTPH1ALDH1A3MEN1
SCHEMBL3890207 0.81 AR (0.45) ARTSHRGABRA1GABRB2CNR2
SCHEMBL3241603 0.78 AR (0.43) ARTSHRTPH1ALDH1A3MEN1
SCHEMBL14758687 0.78 AR (0.43) ARTSHRTPH1CNR2GAA
SCHEMBL5317695 0.78 AR (0.46) ARTSHRTPH1MEN1RAB9A
SCHEMBL8740852 0.78 AR (0.43) ARTSHRTPH1ALDH1A3CNR2
SCHEMBL2211307 0.78 AR (0.43) ARTSHRALDH1A3MEN1RAB9A

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
US-6476021-B1 Compounds having cGMP-PDE inhibitory effect MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2002-11-05 US disclosed
EP-1048666-A1 NOVEL COMPOUNDS HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 EP disclosed