SCHEMBL7559262

SCHEMBL7559262

CCCC(=O)Oc1cccc2c1Cc1ccccc1O2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
KMT2A Q03164 4/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
RECQL P46063 1/20 0.41
DRD2 P14416 2/20 0.40
DRD1 P21728 2/20 0.40
HTR2A P28223 2/20 0.40
HTR1A P08908 1/20 0.40
ALOX15 P16050 1/20 0.37
MTNR1A P48039 3/20 0.37
MTNR1B P49286 3/20 0.37
POLM Q9NP87 1/20 0.36
POLK Q9UBT6 1/20 0.36
POLL Q9UGP5 1/20 0.36
POLH Q9Y253 1/20 0.36
POLB P06746 1/20 0.34
PDGFRB P09619 1/20 0.34

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
SCHEMBL28671388 0.92 MAOA (0.46) LMNAMAOAMAOBKMT2AKDM4E
SCHEMBL28207675 0.91 MAOA (0.42) LMNAMAOAMAOBKMT2AKDM4E
SCHEMBL7560337 0.90 POLM (0.48) KMT2AKDM4EMEN1RECQLDRD2
SCHEMBL4272137 0.90 POLM (0.48) KMT2AKDM4EMEN1RECQLDRD2
SCHEMBL28327108 0.89 MAOA (0.43) MAOAMAOBKMT2AKDM4EMEN1
SCHEMBL22264880 0.89 POLM (0.47) KMT2AKDM4EMEN1RECQLDRD2
SCHEMBL28681972 0.87 MAOA (0.41) LMNAMAOAMAOBKMT2AKDM4E
SCHEMBL28292834 0.85 MAOA (0.42) MAOAMAOBKMT2AKDM4EMEN1
SCHEMBL411459 0.83 MAOA (0.46) LMNAMAOAMAOBKDM4E
SCHEMBL2715642 0.83 MAOA (0.48) MAOAMAOBKDM4EMTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0787005-B1 DERMATOLOGICAL COMPOSITIONS CONTAINING BENZOYL PEROXIDE AND A COMPOUND REDUCING SKIN IRRITATION HERMAL KURT HERRMAN GMBH (DE) 2002-03-27 EP disclosed
US-5932228-A ADMINISTERING BENZOYL PEROXIDE AND COMPOUND THAT REDUCES SKIN IRRITATION THE PROCTER & GAMBLE COMPANY (US) 1999-08-03 US disclosed
EP-0787005-A2 DERMATOLOGICAL COMPOSITIONS CONTAINING BENZOYL PEROXIDE AND A COMPOUND REDUCING SKIN IRRITATION THE PROCTER & GAMBLE COMPANY (US) 1997-08-06 EP disclosed
US-5545407-A ANTIACNE AGENTS THE PROCTER & GAMBLE COMPANY (US) 1996-08-13 US disclosed
WO-1996012498-A2 DERMATOLOGICAL COMPOSITIONS CONTAINING BENZOYL PEROXIDE AND A COMPOUND REDUCING SKIN IRRITATION THE PROCTER & GAMBLE COMPANY (US) 1996-05-02 WO disclosed
US-5445823-A Benzoyl peroxide and a compound for reducing skin irritation associated with it THE PROCTER & GAMBLE COMPANY (US) 1995-08-29 US disclosed