SCHEMBL3738979

SCHEMBL3738979

OC[C@H]1O[C@H](OCc2ccccc2-c2ccccc2)[C@@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.53
PDCD1 Q15116 1/20 0.48
CD274 Q9NZQ7 1/20 0.48
SYNJ2 O15056 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ABL1 P00519 1/20 0.48
ALPL P05186 1/20 0.48
POLB P06746 1/20 0.48
ALPI P09923 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
ALPG P10696 1/20 0.48
PABPC1 P11940 1/20 0.48
RECQL P46063 1/20 0.48
GALK1 P51570 1/20 0.48
CASP7 P55210 1/20 0.48
CASP6 P55212 1/20 0.48
MCL1 Q07820 1/20 0.48
RIN1 Q13671 1/20 0.48
EIF4H Q15056 1/20 0.48

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
SCHEMBL30165720 0.83 PTPN1 (0.55) PTPN1TYRSLC5A2
SCHEMBL31503192 0.83 PTPN1 (0.55) PTPN1TYRSLC5A2
SCHEMBL8638387 0.82 SLC5A2 (0.53) PTPN1SYNJ2SLC5A2
SCHEMBL8638390 0.82 SLC5A2 (0.53) PTPN1SYNJ2SLC5A2
SCHEMBL5265603 0.81 SLC6A2 (0.57) PTPN1SYNJ2KDM4EABL1ALPL
SCHEMBL5026363 0.81 SLC6A2 (0.57) PTPN1SYNJ2KDM4EABL1ALPL
SCHEMBL9849310 0.81 SLC6A2 (0.57) PTPN1SYNJ2KDM4EABL1ALPL
SCHEMBL519034 0.81 SLC6A2 (0.57) PTPN1SYNJ2KDM4EABL1ALPL
SCHEMBL19479665 0.81 SLC6A2 (0.57) PTPN1SYNJ2KDM4EABL1ALPL
SCHEMBL8838912 0.81 SLC6A2 (0.57) PTPN1SYNJ2KDM4EABL1ALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7795302-B2 Use of compositions for treating rosacea THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2010-09-14 US disclosed
US-20080070874-A1 using retinoid or tetracycline as bactericide, benzoyl peroxide as metalloproteinases (MMPs) and neutrophil elastase inhibitors; antiscarring agents; reduction in procollagen biosynthesis THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2008-03-20 US disclosed
US-7268148-B2 Compositions and methods for use against acne-induced inflammation and dermal matrix-degrading enzymes REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-09-11 US disclosed
US-7078048-B2 Method and compositions for treating rosacea THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2006-07-18 US disclosed
US-20060078582-A1 Use of compositions for treating rosacea THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2006-04-13 US disclosed
EP-1385496-A4 USE OF COMPOSITIONS FOR TREATING ROSACEA UNIV MICHIGAN (US) 2006-03-29 EP disclosed
US-20060009494-A1 Compositions and methods for use against acne-induced inflammation and dermal matrix-degrading enzymes VOORHEES JOHN J 2006-01-12 US disclosed
US-20050277695-A1 Compositions and methods for use against acne-induced inflammation and dermal matrix-degrading enzymes VOORHEES JOHN J 2005-12-15 US disclosed
US-20040235950-A1 Compositions and methods for use against acne-induced inflammation and dermal matrix-degrading enzymes REGENTS OF THE UNIVERSITY OF MICHIGAN, THE 2004-11-25 US disclosed
EP-1385496-A2 USE OF COMPOSITIONS FOR TREATING ROSACEA THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2004-02-04 EP disclosed
EP-1284721-A2 COMPOSITIONS AND METHODS FOR USE AGAINST ACNE-INDUCED INFLAMMATION AND DERMAL MATRIX-DEGRADING ENZYMES THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2003-02-26 EP disclosed
US-20020183399-A1 Method and compositions for treating rosacea REGENTS OF THE UNIVERSITY OF MICHIGAN, THE 2002-12-05 US disclosed
WO-2002089743-A2 USE OF COMPOSITIONS FOR TREATING ROSACEA THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2002-11-14 WO disclosed
WO-2001089502-A2 COMPOSITIONS AND METHODS FOR USE AGAINST ACNE-INDUCED INFLAMMATION AND DERMAL MATRIX-DEGRADING ENZYMES THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2001-11-29 WO disclosed