SCHEMBL2802094

SCHEMBL2802094

CCCCCN(C)CC(=O)O.[NaH]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 9/20 0.51
KDM5A P29375 7/20 0.51
KDM5C P41229 1/20 0.51
KDM5B Q9UGL1 1/20 0.51
PHF8 Q9UPP1 2/20 0.50
KDM4A O75164 2/20 0.46
S1PR2 O95136 1/20 0.46
S1PR1 P21453 1/20 0.46
S1PR3 Q99500 1/20 0.46
S1PR5 Q9H228 1/20 0.46
AKR1B1 P15121 1/20 0.44
PPARG P37231 6/20 0.43
PPARD Q03181 6/20 0.43
PPARA Q07869 6/20 0.43
HDAC11 Q96DB2 5/20 0.43
TSHR P16473 4/20 0.43
GPR84 Q9NQS5 4/20 0.43
ALDH1A1 P00352 2/20 0.43
TLR2 O60603 2/20 0.43
TDP1 Q9NUW8 2/20 0.43

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
SCHEMBL394099 0.98 KDM4C (0.53) KDM4CKDM5AKDM5CKDM5BPHF8
SCHEMBL16040076 0.98 KDM4C (0.53) KDM4CKDM5AKDM5CKDM5BPHF8
SCHEMBL7571174 0.98 KDM4C (0.53) KDM4CKDM5AKDM5CKDM5BPHF8
SCHEMBL27285975 0.98 KDM4C (0.53) KDM4CKDM5AKDM5CKDM5BPHF8
SCHEMBL168312 0.98 KDM4C (0.53) KDM4CKDM5AKDM5CKDM5BPHF8
SCHEMBL10610457 0.96 KDM4C (0.54) KDM4CKDM5AKDM5CKDM5BPHF8
SCHEMBL5984529 0.96 KDM4C (0.54) KDM4CKDM5AKDM5CKDM5BPHF8
SCHEMBL41611 0.96 KDM4C (0.54) KDM4CKDM5AKDM5CKDM5BPHF8
SCHEMBL16895244 0.96 KDM4C (0.54) KDM4CKDM5AKDM5CKDM5BPHF8
SCHEMBL1272817 0.96 KDM4C (0.54) KDM4CKDM5AKDM5CKDM5BPHF8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115669662-B Low-irritation-stability unitary peroxyacetic acid disinfectant and preparation method thereof 成都科宏达科技有限公司 2024-04-30 CN claimed
CN-115669662-A Low-irritation stable monoperoxyacetic acid disinfectant and preparation method thereof 成都科宏达科技有限公司 2023-02-03 CN claimed
CN-115521771-A Supermolecule-based environment-friendly foam scrubbing agent and application thereof 西安石油大学 2022-12-27 CN claimed
WO-2024135300-A1 COSMETIC COMPOSITION, COSMETIC COMPOSITION FOR SUPPRESSING DISCOLORATION, AND DISCOLORATION SUPPRESSANT 株式会社資生堂 2024-06-27 WO disclosed
WO-2024135446-A1 SOLID HAIR TREATMENT 資生堂ホネケーキ工業株式会社 2024-06-27 WO disclosed
CN-115669662-B Low-irritation-stability unitary peroxyacetic acid disinfectant and preparation method thereof 成都科宏达科技有限公司 2024-04-30 CN disclosed
EP-4356897-A1 POWDER COSMETIC AND PRODUCTION METHOD FOR SAME Shiseido Company, Ltd. (JP) 2024-04-24 EP disclosed
WO-2024075548-A1 GEL COMPOSITION AND OIL-IN-WATER-TYPE COMPOSITION 株式会社 資生堂 2024-04-11 WO disclosed
WO-2024075678-A1 METHOD FOR PRODUCING BIO-DERIVED BRANCHED ALKYL GLYCERYL ETHER, AND BIO-DERIVED BRANCHED ALKYL GLYCERYL ETHER PRODUCED BY SAID METHOD 株式会社ADEKA 2024-04-11 WO disclosed
WO-2024071313-A1 COSMETIC COMPOSITION AND COSMETIC 株式会社日本触媒 2024-04-04 WO disclosed
US-20230104949-A1 SLURRY COMPOSITION FOR CHEMICAL MECHANICAL POLISHING SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-04-06 US disclosed
US-20070122360-A1 Nonaqueous gel composition for tooth whitening and tooth whitening set LION CORPORATION (JP) 2007-05-31 US disclosed
US-20040219112-A1 Method of whitening teeth, tooth whitening composition and tooth whitening set LION CORPORATION (JP) 2004-11-04 US disclosed
EP-1438953-A1 METHOD OF WHITENING TEETH, TOOTH WHITENING COMPOSITION AND TOOTH WHITENING SET Lion Corporation (JP) 2004-07-21 EP disclosed
EP-0570230-B1 External preparation for skin SHISEIDO CO LTD (JP) 1998-09-30 EP disclosed
US-5714294-A A SHELL-CORE CROSSLINKED COPOLYMER PARTICLES COMPRISING A VINYL MONOMER AND AN ACRYLIC ACID ESTER AND/OR METHACRYLIC ACID ESTER OR DIENE MONOMERS; FIXABLE AT LOW TEMPERATURE, IMPACT STRENGTH, STABILITY, DURABILITY KAO CORPORATION (JP) 1998-02-03 US disclosed
US-5580549-A BLEACHING; 2-HYDROXYBENZOIC ACID COMPOUND SHISEIDO CO., LTD. (JP) 1996-12-03 US disclosed
EP-0737899-A1 ELECTROPHOTOGRAPHIC TONER AND REINFORCEMENT THEREFOR Kao Corporation (JP) 1996-10-16 EP disclosed
EP-0570230-A1 External preparation for skin SHISEIDO COMPANY LIMITED (JP) 1993-11-18 EP disclosed
US-4396400-A WATER, NITROGENOUS CARBOXYLATE OR SULFONATE SURFACTANT SOCIETE ELF FRANCE (FR) 1983-08-02 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-20070122360-A1 Nonaqueous gel composition for tooth whitening and tooth whitening set COL14A1, VDAC1, ACTN1 KDM4C 3456/4885KDM5A 2973/4885KDM5C 2332/4885

“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.