SCHEMBL7317207

SCHEMBL7317207

Cc1cc(C(O)C(C)NCCCc2ccccc2)ccc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 3/20 0.49
▸ LMNA P02545 3/20 0.49
▸ HIF1A Q16665 3/20 0.49
▸ SLC6A2 P23975 3/20 0.49
▸ OPRM1 P35372 3/20 0.49
▸ ADRA1A P35348 3/20 0.49
▸ SLC6A4 P31645 2/20 0.49
▸ CYP2D6 P10635 2/20 0.49
▸ ADRB1 P08588 2/20 0.49
▸ OPRK1 P41145 2/20 0.49
▸ SLC6A3 Q01959 2/20 0.49
▸ GALR3 O60755 1/20 0.49
▸ SIGMAR1 Q99720 9/20 0.48
▸ ADRB3 P13945 1/20 0.48
▸ TMEM97 Q5BJF2 1/20 0.48
▸ HTR1A P08908 1/20 0.47
▸ ADRA2A P08913 1/20 0.47
▸ ADRA2B P18089 1/20 0.47
▸ ADRA2C P18825 1/20 0.47
▸ HTR2A P28223 1/20 0.47

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
Cliropamine SCHEMBL2110690 0.90 ADRB2 (0.49) ADRB2LMNAHIF1ASLC6A2OPRM1
Cliropamine SCHEMBL31741642 0.89 SIGMAR1 (0.50) ADRB2LMNAHIF1ASLC6A2OPRM1
SCHEMBL7381182 0.82 SIGMAR1 (0.57) ADRB2LMNAHIF1ASLC6A2OPRM1
SCHEMBL9483941 0.82 ADRB2 (0.54) ADRB2LMNAHIF1ASLC6A2OPRM1
SCHEMBL11807913 0.82 ADRB1 (0.61) ADRB2LMNAHIF1ASLC6A2OPRM1
SCHEMBL9973172 0.79 LMNA (0.39) ADRB2LMNAHIF1ASLC6A2OPRM1
SCHEMBL10779305 0.77 SIGMAR1 (0.45) ADRB2LMNAHIF1ASLC6A2OPRM1
Hydrochloric Acid SCHEMBL10769677 0.75 ADRB2 (0.65) ADRB2LMNASLC6A2ADRA1ASLC6A4
SCHEMBL8974286 0.75 SIGMAR1 (0.45) ADRB2LMNAHIF1ASLC6A2OPRM1
SCHEMBL11537605 0.75 ADRB1 (0.47) ADRB2LMNAHIF1ASLC6A2OPRM1

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
EP-0135905-A2 1-(Alkyl-hydroxy-phenyl)-1-hydroxy-2-(alkylamino)-propanes ASTA Pharma Aktiengesellschaft (DE) 1985-04-03 — — EP disclosed
Send feedback