SCHEMBL10693763

SCHEMBL10693763

COc1ccc2c(OCCCCNCCO)c3ccccc3cc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
HSD17B10 Q99714 1/20 0.50
KDM4E B2RXH2 2/20 0.48
SLC2A1 P11166 3/20 0.47
TSHR P16473 2/20 0.44
TP53 P04637 2/20 0.44
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
ALOX15 P16050 1/20 0.43
NPC1 O15118 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PPARG P37231 1/20 0.43
HTR1D P28221 1/20 0.42
HTR1B P28222 1/20 0.42
DRD2 P14416 1/20 0.42
DRD4 P21917 1/20 0.42
DRD3 P35462 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL10688006 0.81 CYP1A2 (0.45) SLC2A1L3MBTL1RAB9APPARG
SCHEMBL10694673 0.80 CYP1A2 (0.44) PPARGHTR1B
SCHEMBL10692266 0.79 HTR1B (0.63) ALDH1A1HSD17B10KDM4ETSHRTP53
SCHEMBL10693307 0.78 HTR1B (0.50) ALDH1A1KDM4EHTR1B
SCHEMBL10692155 0.74 SLC2A1 (0.50) ALDH1A1HSD17B10KDM4ESLC2A1HTR1B
SCHEMBL29703007 0.73 CYP1A2 (0.59) ALDH1A1HSD17B10KDM4EL3MBTL1NPC1
SCHEMBL29104917 0.73 CYP1A2 (0.59) ALDH1A1HSD17B10KDM4EL3MBTL1NPC1
SCHEMBL10688747 0.73 RAB9A (0.52) ALDH1A1HSD17B10L3MBTL1RAB9ASMN1; SMN2
SCHEMBL10693321 0.73 CYP1A2 (0.44) ALDH1A1HSD17B10KDM4ESLC2A1L3MBTL1
SCHEMBL10688770 0.72 CYP1A2 (0.42) PPARGHTR1B

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-4792551-A 9-anthryloxyaminoalkanes and related compounds as anti-inflammatory and analgetic agents SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
EP-0132351-A2 9-Anthryloxyaminoalkanes and related compounds, processes for their preparation and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1985-01-30 EP disclosed