SCHEMBL7854096

SCHEMBL7854096

[CH2]c1ccc(O)c(CC=C)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 7/20 0.68
GABRB2 P47870 7/20 0.68
POLB P06746 2/20 0.58
GAA P10253 3/20 0.53
MAPT P10636 3/20 0.53
KMT2A Q03164 3/20 0.53
CNR2 P34972 3/20 0.53
ALOX5 P09917 3/20 0.53
MEN1 O00255 2/20 0.53
CNR1 P21554 2/20 0.53
GABRB1 P18505 1/20 0.53
RXRA P19793 1/20 0.53
GABRA5 P31644 1/20 0.53
GABRA3 P34903 1/20 0.53
GABRA2 P47869 1/20 0.53
ACE2 Q9BYF1 1/20 0.53
SIRT3 Q9NTG7 1/20 0.53
AKR1B1 P15121 2/20 0.51
XDH P47989 2/20 0.48
ALDH1A1 P00352 3/20 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
SCHEMBL71514 0.81 GABRA1 (0.70) GABRA1GABRB2POLBGAAMAPT
SCHEMBL252293 0.81 GABRA1 (1.00) GABRA1GABRB2POLBGAAMAPT
SCHEMBL29892631 0.81 GABRA1 (1.00) GABRA1GABRB2POLBGAAMAPT
SCHEMBL30893166 0.81 GABRA1 (0.70) GABRA1GABRB2POLBGAAMAPT
SCHEMBL3819967 0.79 GABRA1 (0.68) GABRA1GABRB2POLBGAAMAPT
SCHEMBL821126 0.79 GABRA1 (0.72) GABRA1GABRB2POLBGAAMAPT
Hydrochloric Acid SCHEMBL11795018 0.78 GABRA1 (0.66) GABRA1GABRB2POLBGAAMAPT
SCHEMBL2490536 0.78 GABRA1 (0.66) GABRA1GABRB2POLBGAAMAPT
SCHEMBL240238 0.78 GABRA1 (0.66) GABRA1GABRB2POLBGAAMAPT
SCHEMBL20840187 0.78 GABRA1 (0.66) GABRA1GABRB2POLBGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0719258-B1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMA CO LTD (JP) 2001-10-31 EP disclosed
US-5786367-A OXYGEN SCAVENGERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-07-28 US disclosed
EP-0719258-A1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-07-03 EP disclosed
WO-1996002508-A1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-02-01 WO disclosed