SCHEMBL2878712

SCHEMBL2878712

CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=O)C(C)(C)CCC1=O

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.87
ALOX15 P16050 4/20 0.87
ALDH1A1 P00352 9/20 0.67
CYP3A4 P08684 5/20 0.67
APP P05067 4/20 0.67
SNCA P37840 4/20 0.67
TSHR P16473 3/20 0.67
TP53 P04637 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
NR2E1 Q9Y466 1/20 0.67
PTGS1 P23219 4/20 0.54
LMNA P02545 3/20 0.54
DRD3 P35462 2/20 0.54
SLCO1B3 Q9NPD5 1/20 0.54
SLCO1B1 Q9Y6L6 1/20 0.54
RXRA P19793 5/20 0.51
RARA P10276 4/20 0.51
RARB P10826 4/20 0.51
RARG P13631 4/20 0.51
MAPK1 P28482 3/20 0.51

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
SCHEMBL2398379 1.00 MAPT (0.87) MAPTALOX15ALDH1A1CYP3A4APP
Canthaxanthin SCHEMBL19618 0.93 MAPT (1.00) MAPTALOX15ALDH1A1CYP3A4APP
Canthaxanthin SCHEMBL12920083 0.93 MAPT (1.00) MAPTALOX15ALDH1A1CYP3A4APP
Canthaxanthin SCHEMBL8971840 0.93 MAPT (1.00) MAPTALOX15ALDH1A1CYP3A4APP
SCHEMBL8128019 0.91 MAPT (0.90) MAPTALOX15ALDH1A1CYP3A4APP
SCHEMBL8132702 0.91 MAPT (0.90) MAPTALOX15ALDH1A1CYP3A4APP
SCHEMBL13252665 0.91 MAPT (0.90) MAPTALOX15ALDH1A1CYP3A4APP
SCHEMBL2832602 0.90 MAPT (0.92) MAPTALOX15ALDH1A1CYP3A4APP
SCHEMBL7759851 0.88 MAPT (0.85) MAPTALOX15ALDH1A1CYP3A4APP
Canthaxanthin SCHEMBL419514 0.88 MAPT (0.90) MAPTALOX15ALDH1A1CYP3A4APP

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 147 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2167647-A2 REGULATORY T CELLS AND METHODS OF MAKING AND USING SAME LA JOLLA INSTITUTE FOR ALLERGY AND IMMUNOLOGY (US) 2010-03-31 EP claimed
US-20090136470-A1 REGULATORY T CELLS AND METHODS OF MAKING AND USING SAME NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-05-28 US claimed
WO-2008157394-A2 REGULATORY T CELLS AND METHODS OF MAKING AND USING SAME LA JOLLA INSTITUTE FOR ALLERGY AND IMMUNOLOGY (US) 2008-12-24 WO claimed
US-20060281813-A1 Methods of treating hyperproliferative cell disorders RUBIN CHARLES 2006-12-14 US claimed
EP-1628631-A2 METHODS OF TREATING HYPERPROLIFERATIVE CELL DISORDERS Achkar, Charles C. (US) 2006-03-01 EP claimed
EP-1104294-B8 COMPOSITIONS AND METHODS OF TREATING ABNORMAL CELL PROLIFERATION LEO PHARMA AS (DK) 2005-11-23 EP claimed
EP-1104294-B1 COMPOSITIONS AND METHODS OF TREATING ABNORMAL CELL PROLIFERATION LEO PHARMA A S (DK) 2005-09-28 EP claimed
WO-2005000230-A2 METHODS OF TREATING HYPERPROLIFERATIVE CELL DISORDERS ACHKAR CHARLES (US) 2005-01-06 WO claimed
US-6552009-B2 Vitamin D analog and a retinoid, wherein: the retinoid is 4-oxo-retinol, 4-oxo- retinal, or 4-oxo-retinyl ester; also restoring the natural color of gray hair; treating hair and skin disorders GENTRIX LLC 2003-04-22 US claimed
EP-1104294-A4 COMPOSITIONS AND METHODS OF TREATING ABNORMAL CELL PROLIFERATION GENTRIX LLC (US) 2003-02-05 EP claimed
US-20020183388-A1 Use of retinoids plus histone deacetylase inhibitors to inhibit the growth of solid tumors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2002-12-05 US claimed
WO-2002060430-A1 USE OF RETINOIDS PLUS HISTONE DEACETYLASE INHIBITORS TO INHIBIT THE GROWTH OF SOLID TUMORS CORNELL RESEARCH FOUNDATION, INC. (US) 2002-08-08 WO claimed
US-20010049365-A1 Vitamin D analog and a retinoid, wherein: the retinoid is 4-oxo-retinol, 4-oxo- retinal, or 4-oxo-retinyl ester; also restoring the natural color of gray hair; treating hair and skin disorders LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2001-12-06 US claimed
EP-1104294-A1 COMPOSITIONS AND METHODS OF TREATING ABNORMAL CELL PROLIFERATION Achkar, Charles C. (US) 2001-06-06 EP claimed
WO-2000003700-A1 COMPOSITIONS AND METHODS OF TREATING ABNORMAL CELL PROLIFERATION ACHKAR CHARLES C (US) 2000-01-27 WO claimed
US-5962534-A ACNE THERAPY CORNELL RESEARCH FOUNDATION, INC. (US) 1999-10-05 US claimed
US-20240058293-A1 Nutritional Formulas Comprising Medium Chain Fatty Acids or Esters Thereof and Methods Related Thereto UNIV EMORY (US) 2024-02-22 US disclosed
US-11826336-B2 Nutritional formulas comprising medium chain fatty acids or esters thereof and methods related thereto EMORY UNIVERSITY (US) 2023-11-28 US disclosed
US-4049718-A Sulphones RHONE-POULENC, S.A. (FR) 1977-09-20 US disclosed
US-4048234-A Sulphones RHONE-POULENC S.A. (FR) 1977-09-13 US 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 (2 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-20010049365-A1 Vitamin D analog and a retinoid, wherein: the retinoid is 4-oxo-retinol, 4-oxo- retinal, or 4-oxo-retinyl ester; also restoring the natural color of gray hair; treating hair and skin disorders RBP4, VDR, CYP24A1 MAPT 4178/4885ALOX15 970/4885ALDH1A1 234/4885
US-20060281813-A1 Methods of treating hyperproliferative cell disorders HRAS, CDC73, MKI67 MAPT 4706/4885ALOX15 1556/4885ALDH1A1 1302/4885

“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.