SCHEMBL11045247

SCHEMBL11045247

C=CCc1ccccc1C(O)CC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
ALDH1A1 P00352 1/20 0.42
ADRA2C P18825 2/20 0.42
GABRA1 P14867 2/20 0.42
GABRB2 P47870 2/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRB2 P07550 4/20 0.40
ADRB1 P08588 4/20 0.40
TSHR P16473 2/20 0.40
ADRB3 P13945 2/20 0.40
HTR1A P08908 1/20 0.40
SLC6A2 P23975 1/20 0.40
BDKRB2 P30411 1/20 0.40
SLC6A4 P31645 1/20 0.40
ADRA1A P35348 1/20 0.40
HTR2B P41595 1/20 0.40
KCNH2 Q12809 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 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
SCHEMBL7092135 0.85 ADRA2C (0.42) LMNAALDH1A1ADRA2CGABRA1GABRB2
SCHEMBL4059911 0.81 ADRA2C (0.47) LMNAALDH1A1ADRA2CGABRA1GABRB2
SCHEMBL30589993 0.81 ADRA2C (0.47) LMNAALDH1A1ADRA2CGABRA1GABRB2
SCHEMBL9284485 0.81 ADRA2C (0.41) LMNAALDH1A1ADRA2CGABRA1GABRB2
SCHEMBL9806298 0.80 TSHR (0.50) LMNAALDH1A1ADRA2CGABRA1GABRB2
SCHEMBL6269535 0.79 GABRA1 (0.46) LMNAALDH1A1ADRA2CGABRA1GABRB2
SCHEMBL10663159 0.79 LMNA (0.47) LMNAALDH1A1ADRB2ADRB1TSHR
SCHEMBL3924209 0.79 LMNA (0.50) LMNAALDH1A1GABRA1GABRB2TSHR
SCHEMBL3924212 0.79 LMNA (0.50) LMNAALDH1A1GABRA1GABRB2TSHR
SCHEMBL9666849 0.78 ALDH1A1 (0.40) LMNAALDH1A1ADRA2CGABRA1GABRB2

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-0045571-B1 PROCESS FOR THE PRODUCTION OF PHENYL SUBSTITUTED ALDEHYDES AND OF PHENYL SUBSTITUTED ALCOHOLS BUSH BOAKE ALLEN Limited (GB) 1985-06-26 EP claimed
EP-0045571-A1 Process for the production of phenyl substituted aldehydes and of phenyl substituted alcohols BUSH BOAKE ALLEN Limited (GB) 1982-02-10 EP claimed