Biphenyl

Biphenyl

SCHEMBL7588601

C=CCN1CCCC(OC(C)=O)C1.c1ccc(-c2ccccc2)cc1

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
BCHE P06276 4/20 0.47
MAOB P27338 2/20 0.46
CHRNB2 P17787 1/20 0.45
CHRNB4 P30926 1/20 0.45
CHRNA3 P32297 1/20 0.45
CHRNA4 P43681 1/20 0.45
KDM4E B2RXH2 1/20 0.43
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL11124160 0.83 CHRNB2 (0.49) CYP3A4CYP1A2CYP2D6BCHEMAOB
SCHEMBL7588607 0.80 CYP2D6 (0.73) CYP3A4CYP1A2CYP2D6BCHEMAOB
SCHEMBL19038337 0.79 BCHE (0.72) CYP3A4CYP1A2CYP2D6BCHEMAOB
SCHEMBL8523613 0.75 BCHE (0.40) CYP3A4CYP1A2CYP2D6BCHEMAOB
SCHEMBL3756230 0.75 CYP3A4 (0.38) CYP3A4CYP1A2CYP2D6BCHEMAOB
SCHEMBL3756225 0.75 CYP3A4 (0.38) CYP3A4CYP1A2CYP2D6BCHEMAOB
SCHEMBL3757483 0.75 CYP3A4 (0.38) CYP3A4CYP1A2CYP2D6BCHEMAOB
SCHEMBL28750100 0.75 CHRNB4 (0.68) BCHEMAOBCHRNB2CHRNB4CHRNA3
SCHEMBL9672067 0.73 DRD3 (0.47) CYP3A4CYP1A2CYP2D6KDM4E
SCHEMBL25153263 0.72 CYP3A4 (0.57) CYP3A4CYP1A2CYP2D6BCHEMAOB

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-0634932-B1 METHOD FOR REDUCING INTRAOCULAR PRESSURE IN THE MAMMALIAN EYE BY ADMINISTRATION OF MUSCARINIC ANTAGONISTS ALLERGAN INC (US) 2002-06-19 EP disclosed
US-5716952-A TOPICAL APPLICATION ALLERGAN (US) 1998-02-10 US disclosed
EP-0634932-A1 METHOD FOR REDUCING INTRAOCULAR PRESSURE IN THE MAMMALIAN EYE BY ADMINISTRATION OF MUSCARINIC ANTAGONISTS ALLERGAN, INC. (US) 1995-01-25 EP disclosed
WO-1993018772-A1 METHOD FOR REDUCING INTRAOCULAR PRESSURE IN THE MAMMALIAN EYE BY ADMINISTRATION OF MUSCARINIC ANTAGONISTS ALLERGAN, INC. (US) 1993-09-30 WO disclosed