SCHEMBL2153100

SCHEMBL2153100

NCCN(CCO)CC(=O)O.[Na]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.52
KDM4E B2RXH2 2/20 0.52
ALOX15 P16050 2/20 0.52
BLM P54132 2/20 0.52
PMP22 Q01453 2/20 0.52
LMNA P02545 1/20 0.52
CHRM2 P08172 1/20 0.52
ADRA2A P08913 1/20 0.52
TSHR P16473 1/20 0.52
DRD1 P21728 1/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A4 P31645 1/20 0.52
CYP2C19 P33261 1/20 0.52
ADRA1A P35348 1/20 0.52
DRD3 P35462 1/20 0.52
SLC6A3 Q01959 1/20 0.52
HRH3 Q9Y5N1 1/20 0.52
EYA2 O00167 1/20 0.48
APP P05067 1/20 0.48
ACE P12821 1/20 0.48

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
SCHEMBL526346 0.98 BLM (0.54) TDP1KDM4EALOX15BLMPMP22
SCHEMBL2153152 0.96 BLM (0.52) TDP1KDM4EALOX15BLMPMP22
Nitrilotriacetic Acid SCHEMBL21296993 0.91 TDP1 (0.54) TDP1KDM4EALOX15BLMPMP22
SCHEMBL676801 0.89 BLM (0.65) TDP1KDM4EALOX15BLMPMP22
Bicine SCHEMBL30968399 0.89 TDP1 (0.65) TDP1KDM4EALOX15BLMPMP22
Bicine SCHEMBL867955 0.86 TDP1 (0.56) TDP1KDM4EALOX15BLMPMP22
Hydrochloric Acid SCHEMBL9406491 0.86 BLM (0.62) TDP1KDM4EALOX15BLMPMP22
Bicine SCHEMBL177696 0.86 ALOX15 (0.68) TDP1KDM4EALOX15BLMPMP22
Bicine SCHEMBL34161 0.86 ALOX15 (0.68) TDP1KDM4EALOX15BLMPMP22
SCHEMBL3416374 0.84 TDP1 (0.75) TDP1KDM4EALOX15BLMPMP22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102365077-B oral composition LION CORP 2013-10-16 CN claimed
CN-102365077-A oral composition LION CORP 2012-02-29 CN claimed
WO-2023017790-A1 CLEANING COMPOSITION AND PRODUCTION METHOD FOR SAME ロート製薬株式会社 2023-02-16 WO disclosed
CN-114728182-A Detergent composition for foaming agent 味之素株式会社 2022-07-08 CN disclosed
US-20200247928-A1 COPOLYMER HAVING CARBOSILOXANE DENDRIMER STRUCTURE AND ACIDIC GROUP, COMPOSITION CONTAINING SAME, AND COSMETIC DOW TORAY CO., LTD. (JP) 2020-08-06 US disclosed
CN-110352248-A The production method of utility 三洋化成工业株式会社 2019-10-18 CN disclosed
EP-3524228-A1 COSMETIC COMPOSITION OR EXTERNAL COMPOSITION, AND COSMETIC RAW MATERIAL COMPOSITION Dow Silicones Corporation (US) 2019-08-14 EP disclosed
CN-107106440-A Shampoo compositions 株式会社高丝 2017-08-29 CN disclosed
CN-104203209-B Hair cosmetic composition 株式会社高丝 2017-06-16 CN disclosed
CN-104981500-A Low platinum content hydrosilylation reaction-crosslinkable silicone rubber powder DOW CORNING TORAY CO LTD 2015-10-14 CN disclosed
CN-102666664-B The organopolysiloxane of modification altogether DOW CORNING TORAY CO.,LTD. (JP) 2015-09-23 CN disclosed
EP-2519587-A1 PHENYL-CONTAINING ORGANOPOLYSILOXANE COMPOSITION, RAW COSMETIC MATERIAL, AND GLOSSY COSMETIC MATERIAL Dow Corning Toray Co., Ltd. (JP) 2012-11-07 EP disclosed
CN-102712759-A Thickener or gelling agent for oil material, gel composition comprising the thickener or gelling agent, and method for producing cosmetic material or topical agent DOW CORNING TORAY CO LTD 2012-10-03 CN disclosed
CN-102686646-A Surface treatment agent for powder used in cosmetic and cosmetic containing powder treated with the same DOW CORNING TORAY CO LTD 2012-09-19 CN disclosed
CN-102365077-A oral composition LION CORP 2012-02-29 CN disclosed
WO-2011081218-A1 PHENYL-CONTAINING ORGANOPOLYSILOXANE COMPOSITION, RAW COSMETIC MATERIAL, AND GLOSSY COSMETIC MATERIAL DOW CORNING TORAY CO., LTD. (JP) 2011-07-07 WO disclosed
CN-101610752-A Cosmetics SHISEIDO CO LTD (JP) 2009-12-23 CN disclosed
CN-101489948-A Non-fogging preproduction, non-fogging articles and coating fluid for the articles CENTRAL GLASS CO LTD (JP) 2009-07-22 CN disclosed
CN-101472979-A Polyether-modified organopolysiloxane, diorganopolysiloxane-polyether block copolymer, processes for producing these, and cosmetic DOW CORNING TORAY CO LTD (JP) 2009-07-01 CN disclosed
CN-101317813-A Skin detergent SANSHO COSMETAINMENT INTERNAT (JP) 2008-12-10 CN 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-20200247928-A1 COPOLYMER HAVING CARBOSILOXANE DENDRIMER STRUCTURE AND ACIDIC GROUP, COMPOSITION CONTAINING SAME, AND COSMETIC WASHC5, ADCY1, ADCY8 TDP1 2375/4885KDM4E 3746/4885ALOX15 59/4885

“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.