SCHEMBL1322241

SCHEMBL1322241

O=C(CCSCCC(=O)OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
MAPK1 P28482 2/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
TDP1 Q9NUW8 3/20 0.52
KMT2A Q03164 2/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A3 Q01959 1/20 0.52
LMNA P02545 3/20 0.50
CYP2C19 P33261 1/20 0.50
CDC25B P30305 1/20 0.50
HCAR2 Q8TDS4 1/20 0.47
NOTUM Q6P988 1/20 0.47
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 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
SCHEMBL5014522 0.95 CYP2C19 (0.59) ALDH1A1MAPK1L3MBTL1TDP1KMT2A
SCHEMBL10802393 0.91 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1TDP1KMT2A
SCHEMBL9008179 0.91 ALDH1A1 (0.51) ALDH1A1MAPK1L3MBTL1TDP1KMT2A
SCHEMBL1200459 0.90 ALDH1A1 (0.54) ALDH1A1MAPK1L3MBTL1TDP1KMT2A
SCHEMBL1200472 0.89 ALDH1A1 (0.61) ALDH1A1MAPK1L3MBTL1TDP1KMT2A
SCHEMBL12786305 0.88 ALDH1A1 (0.49) ALDH1A1MAPK1L3MBTL1TDP1KMT2A
SCHEMBL19177185 0.87 MEN1 (0.51) ALDH1A1MAPK1L3MBTL1KMT2ALMNA
SCHEMBL8894504 0.87 ALDH1A1 (0.51) ALDH1A1MAPK1L3MBTL1TDP1KMT2A
SCHEMBL1177836 0.86 ALDH1A1 (0.73) ALDH1A1MAPK1L3MBTL1TDP1KMT2A
SCHEMBL23197318 0.86 ALDH1A1 (0.58) ALDH1A1MAPK1L3MBTL1TDP1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2703475-B1 USE FOR IMPROVING STORAGE STABILITY OF A LUBRICATING OIL ADDITIVE COMPOSITION ADEKA CORP (JP) 2018-06-13 EP disclosed
US-20170210778-A1 NOVEL COMPOUNDS INVIVOGEN SAS (FR) 2017-07-27 US disclosed
US-9255237-B2 Lubricating oil additive composition and method for improving storage stability of lubricating oil additive composition ADEKA CORPORATION (JP) 2016-02-09 US disclosed
EP-2511353-B1 INK COMPOSITION FOR A WATER-BASED BALLPOINT PEN, AND WATER-BASED BALLPOINT PEN MITSUBISHI PENCIL CO (JP) 2015-09-16 EP disclosed
EP-2703475-A1 LUBRICATING OIL ADDITIVE COMPOSITION AND METHOD FOR IMPROVING STORAGE STABILITY OF LUBRICATING OIL ADDITIVE COMPOSITION Adeka Corporation (JP) 2014-03-05 EP disclosed
US-20140045738-A1 LUBRICATING OIL ADDITIVE COMPOSITION AND METHOD FOR IMPROVING STORAGE STABILITY OF LUBRICATING OIL ADDITIVE COMPOSITION ADEKA CORPORATION (JP) 2014-02-13 US disclosed
US-8562235-B2 Ink composition for aqueous ink ball point pen and aqueous ink ball point pen MITSUBISHI PENCIL CO., LTD. (JP) 2013-10-22 US disclosed
US-8525954-B2 Three-dimensional display article GENERAL ELECTRIC COMPANY (US) 2013-09-03 US disclosed
EP-2511353-A1 INK COMPOSITION FOR A WATER-BASED BALLPOINT PEN, AND WATER-BASED BALLPOINT PEN Mitsubishi Pencil Company, Limited (JP) 2012-10-17 EP disclosed
US-20120251222-A1 INK COMPOSITION FOR AQUEOUS INK BALL POINT PEN AND AQUEOUS INK BALL POINT PEN MITSUBISHI PENCIL CO., LTD. (JP) 2012-10-04 US disclosed
US-20030113605-A1 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-06-19 US disclosed
US-20030059459-A1 Method of treating hair with heat and a cap which provides a signal regarding treatment UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-03-27 US disclosed
WO-2003024267-A2 METHOD OF TREATING HAIR WITH HEAT AND A CAP WHICH PROVIDES A SIGNAL REGARDING TREATMENT UNILEVER PLC (GB) 2003-03-27 WO disclosed
US-6537335-B1 Solid transparent gel with a thermochromic or photochromic pigment dispersed evenly throughout; clear gel liquid base material comprised of hydrogenated polyisobutene and glutamic acid polyamide DRAGOCO GERBERDING & CO. AG (DE) 2003-03-25 US disclosed
EP-1289041-A2 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-05 EP disclosed
EP-1090977-A2 Color changing candle Dragoco Gerberding & Co Aktiengesellschaft (DE) 2001-04-11 EP disclosed
CN-1254731-A Latent thiol stabilizer for improving ageing nature of transparent composition containing helogen polymer MORTON INT INC (US) 2000-05-31 CN disclosed
US-5431697-A Reversibly variable color patterning composition for synthetic resin articles MATSUI SHIKISO CHEMICAL CO., LTD. (JP) 1995-07-11 US disclosed
US-4863982-A HEAT, LIGHT AND OXIDATION STABILIZERS CIBA-GEIGY CORPORATION (US) 1989-09-05 US disclosed
US-4699939-A OXIDATION RESISTANCE, PHOTOSTABILITY CIBA-GEIGY CORPORATION (US) 1987-10-13 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 (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-20170210778-A1 NOVEL COMPOUNDS F12, C1R, F11 ALDH1A1 2273/4885MAPK1 2092/4885L3MBTL1 3046/4885

“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.