SCHEMBL2492545

SCHEMBL2492545

CCCCCN(C)C(C)=O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 5/20 0.46
EPHX2 P34913 5/20 0.44
ALDH1A1 P00352 1/20 0.41
S1PR2 O95136 1/20 0.41
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41
S1PR5 Q9H228 1/20 0.41
CES2 O00748 4/20 0.40
CES1 P23141 4/20 0.40
SIGMAR1 Q99720 1/20 0.40
KDM5A P29375 1/20 0.39
KDM5C P41229 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
KDM5B Q9UGL1 1/20 0.39
AKR1B1 P15121 1/20 0.39
GGPS1 O95749 1/20 0.38

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
SCHEMBL4601205 0.98 DNM1 (0.50) DNM1EPHX2ALDH1A1S1PR2S1PR1
SCHEMBL16658724 0.98 DNM1 (0.50) DNM1EPHX2ALDH1A1S1PR2S1PR1
SCHEMBL16658678 0.98 DNM1 (0.50) DNM1EPHX2ALDH1A1S1PR2S1PR1
SCHEMBL16658679 0.98 DNM1 (0.50) DNM1EPHX2ALDH1A1S1PR2S1PR1
SCHEMBL3440790 0.98 DNM1 (0.50) DNM1EPHX2ALDH1A1S1PR2S1PR1
SCHEMBL6949703 0.98 DNM1 (0.50) DNM1EPHX2ALDH1A1S1PR2S1PR1
SCHEMBL2180094 0.98 DNM1 (0.50) DNM1EPHX2ALDH1A1S1PR2S1PR1
SCHEMBL1902069 0.98 DNM1 (0.50) DNM1EPHX2ALDH1A1S1PR2S1PR1
SCHEMBL18660081 0.98 DNM1 (0.50) DNM1EPHX2ALDH1A1S1PR2S1PR1
SCHEMBL2485136 0.98 DNM1 (0.50) DNM1EPHX2ALDH1A1S1PR2S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2370486-A1 BRUSH COPOLYMERS Bausch & Lomb Incorporated (US) 2011-10-05 EP claimed
WO-2010078149-A1 BRUSH COPOLYMERS BAUSCH & LOMB INCORPORATED (US) 2010-07-08 WO claimed
EP-3596075-B1 AZAINDOLES AS INHIBITORS OF HPK1 HOFFMANN LA ROCHE (CH) 2023-10-11 EP disclosed
CN-115232451-B Polyhydroxyalkanoate material or product capable of being rapidly crystallized and preparation method thereof 四川大学 2023-08-04 CN disclosed
US-20230130155-A1 MRNAS ENCODING METABOLIC REPROGRAMMING POLYPEPTIDES AND USES THEREOF ARES CAPITAL CORPORATION, AS AGENT 2023-04-27 US disclosed
US-11352352-B2 Aminopyrimidine compound, preparation method therefor and use thereof Beijing Adamadle Biotechnology Limited Liability Company (CN) 2022-06-07 US disclosed
US-20200087296-A1 AMINOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Beijing Adamadle Biotechnology Limited Liability Company (CN) 2020-03-19 US disclosed
US-20170102627-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2017-04-13 US disclosed
EP-3148646-A1 COSMETIC COMPOSITION FOR MAKE UP AND FOR TAKING CARE OF KERATIN MATERIALS L'Oréal (FR) 2017-04-05 EP disclosed
US-9345709-B2 1,5-naphthyridine derivatives and MELK inhibitors containing the same ONCOTHERAPY SCIENCE, INC. (JP) 2016-05-24 US disclosed
EP-2970104-A1 BICYCLIC ANALGESIC COMPOUNDS Kalyra Pharmaceuticals Inc. (US) 2016-01-20 EP disclosed
EP-1379238-A1 FAVORABLE MODULATION OF HEALTH-RELATED QUALITY OF LIFE AND HEALTH-RELATED QUALITY-ADJUSTED TIME-TO-PROGRESSION OF DISEASE IN PATIENTS WITH PROSTATE CANCER Abbott Laboratories (US) 2004-01-14 EP disclosed
US-20030092757-A1 Favorable modulation of health-related quality of life and health-related quality-adjusted time-to-progression of disease in patients with prostate cancer ABBOTT LABORATORIES 2003-05-15 US disclosed
EP-1307175-A2 HAIR STYLING COMPOSITION Unilever Plc (GB) 2003-05-07 EP disclosed
WO-2002085351-A1 FAVORABLE MODULATION OF HEALTH-RELATED QUALITY OF LIFE AND HEALTH-RELATED QUALITY-ADJUSTED TIME-TO-PROGRESSION OF DISEASE IN PATIENTS WITH PROSTATE CANCER ABBOTT LABORATORIES (US) 2002-10-31 WO disclosed
WO-2002011686-A2 HAIR STYLING COMPOSITION UNILEVER PLC (GB) 2002-02-14 WO disclosed
US-5990070-A GRANULAR LAUNDRY DETERGENT WITH HYDROGEN PEROXIDE SOURCE, MOISTURE-ACTIVATED HYDROPHOBIC BLEACH ACTIVATOR CELLULAR MATRIX MICROCAPSULES COMPRISING POLYSACCHARIDE OR POLYHYDROXY COMPOUND ENCAPSULATING ACTIVATOR IN SPECIFIC MOLAR RATIO THE PROCTER & GAMBLE COMPANY (US) 1999-11-23 US disclosed
US-5905067-A COMPLEXED WITH A CYCLODEXTRIN; SUITABLE FOR IN CLEANING PRODUCTS SUCH AS GRANULAR LAUNDRY DETERGENTS, GRANULAR AUTOMATIC DISHWASHER DETERGENTS, GRANULAR HARD SURFACE CLEANERS AND LAUNDRY BARS PROCTER & GAMBLE COMPANY (US) 1999-05-18 US disclosed
EP-0859047-A2 A system for delivering hydrophobic liquid bleach activators THE PROCTER & GAMBLE COMPANY (US) 1998-08-19 EP disclosed
WO-1998012143-A1 PROCESS FOR CLEANING WASTEWATER AND RECIRCULATING WATER IN PAPER PRODUCTION, DE-INKING AND BLEACHING OF PULP BASF AKTIENGESELLSCHAFT (DE) 1998-03-26 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 (4 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-20030092757-A1 Favorable modulation of health-related quality of life and health-related quality-adjusted time-to-progression of disease in patients with prostate cancer KLK3, ACP3, BPHL DNM1 2525/4885EPHX2 4249/4885ALDH1A1 1863/4885
US-20230130155-A1 MRNAS ENCODING METABOLIC REPROGRAMMING POLYPEPTIDES AND USES THEREOF HMOX1, CD209, HMOX2 DNM1 3539/4885EPHX2 776/4885ALDH1A1 115/4885
US-20200087296-A1 AMINOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF WEE1, WEE2, EGFR DNM1 2451/4885EPHX2 1290/4885ALDH1A1 1646/4885
US-11352352-B2 Aminopyrimidine compound, preparation method therefor and use thereof WEE1, WEE2, EGFR DNM1 2451/4885EPHX2 1290/4885ALDH1A1 1646/4885

“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.