Betaine

Betaine

SCHEMBL6140458

C=C(C)COC(C)[N+](C)(C)CC(=O)O.C[N+](C)(C)CC(=O)O

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

BHMTBHMT2

The experimentally established mechanism targets of Betaine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
APEX1 P27695 1/20 0.44
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30

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
Betaine SCHEMBL22686151 0.88 TSHR (0.40) TSHRALDH1A1LMNAAPEX1
Betaine SCHEMBL21712604 0.83 TSHR (0.36) TSHRALDH1A1LMNAAPEX1
Betaine SCHEMBL907529 0.81 TSHR (0.34) TSHRALDH1A1LMNAAPEX1
Betaine SCHEMBL8807531 0.81 BBOX1 (0.40) TSHRALDH1A1LMNAAPEX1
Betaine SCHEMBL3113299 0.77 TSHR (0.45) TSHRALDH1A1LMNAAPEX1CHRM2
Betaine SCHEMBL7974165 0.77 TSHR (0.35) TSHRALDH1A1LMNAAPEX1
SCHEMBL9344883 0.73
Betaine SCHEMBL9330112 0.73 TSHR (0.32) TSHRALDH1A1LMNAAPEX1
SCHEMBL14311922 0.71 TSHR (0.40) TSHRALDH1A1LMNAAPEX1CHRM2
SCHEMBL947653 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5512277-A APPLYING CATIONIC POLYMER HAVING SALT FORMING GROUP TO SKIN, PEELING OFF AFTER DRYING KAO CORPORATION (JP) 1996-04-30 US claimed
US-20240084186-A1 DEVELOPMENT OF ULTRA-HIGH MOLECULAR WEIGHT (UHMW) BRANCHED BLOCK COPOLYMER SHALE INHIBITOR FOR WATER BASED DRILLING FLUID SAUDI ARABIAN OIL COMPANY (SA) 2024-03-14 US disclosed
US-20180289550-A1 SYSTEMS, APPARATUSES, KITS AND METHODS FOR IMPROVED MEDICAL PROCEDURES Advent Access Pte. Ltd. (SG) 2018-10-11 US disclosed
WO-2018185555-A2 SYSTEMS, APPARATUSES, KITS AND METHODS FOR IMPROVED MEDICAL PROCEDURES Advent Access Pte. Ltd. (SG) 2018-10-11 WO disclosed
EP-1202709-B1 COSMETIC STRIP WITH AN AGENT FOR INDUCING A TEMPERATURE CHANGE UNILEVER PLC (GB) 2005-09-28 EP disclosed
US-6607719-B2 Applying a polymer compound having a salt forming group to the skin and peeling KAO CORPORATION (JP) 2003-08-19 US disclosed
US-6494856-B1 Swab deliverable actives UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-12-17 US disclosed
EP-0971684-B1 KERATOTIC PLUG REMOVER UNILEVER PLC (GB) 2002-12-11 EP disclosed
US-6488646-B1 Swab deliverable actives UNILEVER HOME & PERSONAL CARE USA 2002-12-03 US disclosed
US-20020048560-A1 Keratotic plug remover KAO CORPORATION (JP) 2002-04-25 US disclosed
US-6106857-A Fragranced cosmetic product for removal of keratotic plugs from skin pores CHESEBROUGH-POND'S USA CO., DIVISION OF CONOPCO, INC. (US) 2000-08-22 US disclosed
EP-0826364-B1 Keratotic plug remover KAO CORP (JP) 1999-12-29 EP disclosed
US-5993838-A STRIP INCLUDES A FLEXIBLE SUBSTRATE SHEET ONTO WHICH A COMPOSITION CONTAINING AN ADHESIVE POLYMER IS DEPOSITED; TREATED TO BECOME DRY NON-TACKY TO THE TOUCH YET UPON BEING WETTED FOR USE THE COMPOSITION AGAIN TURNS TACKY AND MOBILE. CHESEBROUGH-POND'S USA CO., (US) 1999-11-30 US disclosed
US-5985300-A PORE CLEANSING CHESEBROUGH-POND'S USA CO. (US) 1999-11-16 US disclosed
EP-0949275-A1 METHOD FOR THE PURIFICATION OF IONIC POLYMERS Kao Corporation (JP) 1999-10-13 EP disclosed
US-5935596-A COSMETIC; REMOVE KERATOTIC PLUGS FROM SKIN CHESEBROUGH-POND'S USA CO. (US) 1999-08-10 US disclosed
EP-0826364-A2 Keratotic plug remover KAO CORPORATION (JP) 1998-03-04 EP disclosed
EP-0514760-B1 Keratotic plug remover KAO CORP (JP) 1997-04-23 EP disclosed
US-5512277-A APPLYING CATIONIC POLYMER HAVING SALT FORMING GROUP TO SKIN, PEELING OFF AFTER DRYING KAO CORPORATION (JP) 1996-04-30 US disclosed
EP-0514760-A1 Keratotic plug remover KAO CORPORATION (JP) 1992-11-25 EP 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-20020048560-A1 Keratotic plug remover KRT18, CUTA, DSG1 TSHR 4367/4885ALDH1A1 3981/4885LMNA 2515/4885

“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.