SCHEMBL466097

SCHEMBL466097

O=C(OCc1ccccc1)C(O)(O)O.[NaH]

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
KMT2A Q03164 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
MAPK1 P28482 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
SLC6A2 P23975 1/20 0.55
SLC6A3 Q01959 1/20 0.55
LMNA P02545 3/20 0.50
HCAR2 Q8TDS4 1/20 0.50
MEN1 O00255 1/20 0.49
PTPRC P08575 1/20 0.47
PTPN1 P18031 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
TSHR P16473 1/20 0.45

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
SCHEMBL27923357 0.82 ALDH1A1 (0.55) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL3756497 0.82 ALDH1A1 (0.60) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL24347012 0.82 ALDH1A1 (0.60) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL9579513 0.82 ALDH1A1 (0.59) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL19795773 0.81 KMT2A (0.59) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL27552966 0.81 ALDH1A1 (0.53) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL991531 0.80 ALDH1A1 (0.62) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL3296385 0.80 ALDH1A1 (0.57) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL522510 0.80 ALDH1A1 (0.62) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL988839 0.80 ALDH1A1 (0.62) ALDH1A1KMT2ATDP1MAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2906193-B1 MODIFIED HYALURONIC ACID DERIVATIVES AND USE THEREOF SIGMA TAU IND FARMACEUTI (IT) 2016-09-28 EP disclosed
US-20150252120-A1 MODIFIED HYALURONIC ACID DERIVATIVES AND USE THEREOF SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2015-09-10 US disclosed
EP-2906193-A1 MODIFIED HYALURONIC ACID DERIVATIVES AND USE THEREOF Sigma-Tau Industrie Farmaceutiche Riunite S.P.A. (IT) 2015-08-19 EP disclosed
US-20140322149-A1 COMPOUND USEFUL FOR TREATING CELLULITE SIGMA TAU IND FARMACEUTI (IT) 2014-10-30 US disclosed
US-20110217252-A1 COMPOUND USEFUL FOR TREATING CELLULITE SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2011-09-08 US disclosed
EP-2344153-A1 COMPOUND USEFUL FOR TREATING CELLULITE SIGMA-TAU Industrie Farmaceutiche Riunite S.p.A. (IT) 2011-07-20 EP disclosed
US-7854939-B2 Gel useful for the delivery of cosmetic active ingredients SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2010-12-21 US disclosed
WO-2010054978-A1 COMPOUND USEFUL FOR TREATING CELLULITE SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2010-05-20 WO disclosed
EP-2152225-A1 GEL USEFUL FOR THE DELIVERY OF COSMETIC ACTIVE INGREDIENTS SIGMA-TAU Industrie Farmaceutiche Riunite S.p.A. (IT) 2010-02-17 EP disclosed
US-20090312421-A1 GEL USEFUL FOR THE DELIVERY OF COSMETIC ACTIVE INGREDIENTS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE SPA (IT) 2009-12-17 US disclosed
WO-2008138393-A1 GEL USEFUL FOR THE DELIVERY OF COSMETIC ACTIVE INGREDIENTS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2008-11-20 WO disclosed
US-20080279900-A1 GEL USEFUL FOR THE DELIVERY OF COSMETIC ACTIVE INGREDIENTS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE SPA (IT) 2008-11-13 US disclosed
EP-1214048-B1 USE OF CONJUGATED LINOLEIC ACID (CLA) FOR THE TOPICAL TREATMENT OF CELLULITE PENTAPHARM LTD (CH) 2006-03-29 EP disclosed
US-6953583-B1 Use of conjugated linoleic acid (CLA) for the topical treatment of cellulite PENTAPHARM AG (CH) 2005-10-11 US disclosed
EP-1214048-A1 USE OF CONJUGATED LINOLEIC ACID (CLA) FOR THE TOPICAL TREATMENT OF CELLULITE PENTAPHARM Ltd. (CH) 2002-06-19 EP disclosed
WO-2001017498-A1 USE OF CONJUGATED LINOLEIC ACID (CLA) FOR THE TOPICAL TREATMENT OF CELLULITE PENTAPHARM LTD. (CH) 2001-03-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150252120-A1 MODIFIED HYALURONIC ACID DERIVATIVES AND USE THEREOF CD44, MMP1, GLA ALDH1A1 37/4885KMT2A 3302/4885TDP1 1905/4885
US-20080279900-A1 GEL USEFUL FOR THE DELIVERY OF COSMETIC ACTIVE INGREDIENTS SLC25A20, CRAT, CUTA ALDH1A1 2427/4885KMT2A 3957/4885TDP1 2299/4885
US-20090312421-A1 GEL USEFUL FOR THE DELIVERY OF COSMETIC ACTIVE INGREDIENTS SLC25A20, CRAT, UGCG ALDH1A1 1957/4885KMT2A 3926/4885TDP1 2447/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.