SCHEMBL4729408

SCHEMBL4729408

COC(=O)C(c1ccccc1O)N(CCN)C(C(=O)OC)c1ccccc1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
KMT2A Q03164 4/20 0.36
MEN1 O00255 2/20 0.36
ALOX15 P16050 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 1/20 0.35
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA7 P43166 2/20 0.35
CA9 Q16790 2/20 0.35
CA14 Q9ULX7 2/20 0.35
POLB P06746 1/20 0.34
PTPN9 P43378 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
EPOR P19235 1/20 0.33
NR1H2 P55055 1/20 0.32

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
SCHEMBL157144 0.82 TSHR (0.37) TSHRALOX15GABRA1GABRB2ALDH1A1
SCHEMBL10615720 0.79 PTPN9 (0.35) TSHRALOX15GABRA1GABRB2ALDH1A1
SCHEMBL19362158 0.75 POLB (0.34) TSHRALOX15GABRA1GABRB2POLB
SCHEMBL6580109 0.74 PTPN9 (0.34) TSHRALOX15GABRA1GABRB2ALDH1A1
SCHEMBL27901422 0.71 ALDH1A1 (0.57) TSHRKMT2AGABRA1GABRB2LMNA
Hydrochloric Acid SCHEMBL27524511 0.70 GABRA1 (0.44) TSHRKMT2AMEN1GABRA1GABRB2
Hydrochloric Acid SCHEMBL8622407 0.70 GABRA1 (0.44) TSHRKMT2AMEN1GABRA1GABRB2
SCHEMBL18177743 0.70 GABRA1 (0.47) TSHRKMT2AGABRA1GABRB2LMNA
SCHEMBL31517035 0.70 GABRA1 (0.52) TSHRKMT2AMEN1GABRA1GABRB2
SCHEMBL1345444 0.70 GABRA1 (0.52) TSHRKMT2AMEN1GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070191368-A1 Inhibition of tissue damage to skin from radiation treatment therapy BISSETT DONALD L 2007-08-16 US claimed
WO-2003002119-A1 TREATMENT AND PREVENTION OF LIPODERMATOSCLEROSIS JOHNSON & JOHNSON MEDICAL LIMITED (GB) 2003-01-09 WO claimed
US-5487884-A CYTOPROTECTIVE AGENTS BY RADIATION RESISTANCE TO PREVENT SKIN CANCER AND PREMATURE AGING THE PROCTER & GAMBLE COMPANY (US) 1996-01-30 US claimed
EP-0496434-A2 Photoprotection compositions comprising chelating agents THE PROCTER & GAMBLE COMPANY (US) 1992-07-29 EP claimed
EP-0313305-A2 Photoprotection compositions comprising chelating agents THE PROCTER & GAMBLE COMPANY (US) 1989-04-26 EP claimed
WO-2008035152-A1 COSMETIC METHOD TO REMOVE THE DARK UNDEREYE MARKS GHISALBERTI CARLO (BR) 2008-03-27 WO disclosed
US-20070191368-A1 Inhibition of tissue damage to skin from radiation treatment therapy BISSETT DONALD L 2007-08-16 US disclosed
US-20050020672-A1 Methods of extending mammalian life span via iron chelating compounds that reduce free radical damage in mammals THE PROCTER & GAMBLE COMPANY 2005-01-27 US disclosed
WO-2003002119-A1 TREATMENT AND PREVENTION OF LIPODERMATOSCLEROSIS JOHNSON & JOHNSON MEDICAL LIMITED (GB) 2003-01-09 WO disclosed
US-5922758-A REDUCING OR PREVENTING OZONE, SMOKE AND/OR POLLUTION DAMAGE TO MAMMALIAN SKIN BY APPLYING A MAMMALIAN SKIN AN EFFECTIVE AMOUNT OF COMPOUND SELECTED FROM 2,4-DIENOIC ACID ESTER OF TOCOPHEROLS, SUCH AS ALPHA, BETA, ZETA1, ZETA2 AND OTHERS THE PROCTER & GAMBLE COMPANY (US) 1999-07-13 US disclosed
US-5739156-A ADMINISTERING TO REDUCE NONULTRAVIOLET-INDUCED FREE RADICAL DAMAGE OR AGING THE PROCTER & GAMBLE COMPANY (US) 1998-04-14 US disclosed
US-5487884-A CYTOPROTECTIVE AGENTS BY RADIATION RESISTANCE TO PREVENT SKIN CANCER AND PREMATURE AGING THE PROCTER & GAMBLE COMPANY (US) 1996-01-30 US disclosed
EP-0496433-A2 Photoprotection compositions comprising chelating agents THE PROCTER & GAMBLE COMPANY (US) 1992-07-29 EP disclosed
EP-0496434-A2 Photoprotection compositions comprising chelating agents THE PROCTER & GAMBLE COMPANY (US) 1992-07-29 EP disclosed
EP-0313305-A2 Photoprotection compositions comprising chelating agents THE PROCTER & GAMBLE COMPANY (US) 1989-04-26 EP 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 (1 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-20050020672-A1 Methods of extending mammalian life span via iron chelating compounds that reduce free radical damage in mammals TXNRD2, PRDX5, PLPBP TSHR 918/4885KMT2A 1101/4885MEN1 2887/4885

“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.