SCHEMBL45010

SCHEMBL45010

N=C(N)NC(=N)N1CCCCCC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.54
ALDH1A1 P00352 5/20 0.33
TSHR P16473 1/20 0.32
CA2 P00918 4/20 0.32
CHKA P35790 1/20 0.32
CA1 P00915 3/20 0.32
CA12 O43570 2/20 0.32
CA9 Q16790 2/20 0.32
MGLL Q99685 2/20 0.31
PIN1 Q13526 1/20 0.31
PHGDH O43175 1/20 0.31
ALDH2 P05091 1/20 0.31
FBP1 P09467 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL2953468 1.00 F2 (0.54) F2ALDH1A1TSHRCA2CHKA
SCHEMBL12096425 1.00 F2 (0.54) F2ALDH1A1TSHRCA2CHKA
Hydrochloric Acid SCHEMBL29808003 0.98 F2 (0.52) F2ALDH1A1TSHRCA2CHKA
Hydrochloric Acid SCHEMBL8515090 0.98 F2 (0.52) F2ALDH1A1TSHRCA2CHKA
Hydrochloric Acid SCHEMBL368028 0.98 F2 (0.52) F2ALDH1A1TSHRCA2CHKA
Bromide SCHEMBL7249927 0.98 F2 (0.52) F2ALDH1A1TSHRCA2CHKA
SCHEMBL2950074 0.98 F2 (0.50) F2ALDH1A1HPGD
Boric Acid SCHEMBL17417184 0.94 F2 (0.48) F2ALDH1A1
Sulfuric Acid SCHEMBL2816753 0.90 F2 (0.45) F2ALDH1A1TSHRCA2CHKA
Phosphoric Acid SCHEMBL17022775 0.90 F2 (0.45) F2ALDH1A1TSHRCA2CHKA

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

Appears in 5341 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240218291-A1 CONTACT LENS TREATING SOLUTION JPMORGAN CHASE BANK, N.A., AS SUCCESSOR AGENT 2024-07-04 US claimed
WO-2024132271-A1 CONTACT LENS TREATING SOLUTION BAUSCH + LOMB IRELAND LIMITED (IE) 2024-06-27 WO claimed
CN-118234379-A Preservative composition 阿尔萨达股份公司 2024-06-21 CN claimed
US-20240189489-A1 DEVICES AND METHODS FOR CONTACTING LIVING TISSUE ISL, LLC (US) 2024-06-13 US claimed
EP-3836851-B1 ABRADABLE THERAPEUTIC COATINGS AND DEVICES INCLUDING SUCH COATINGS ETHICON INC (US) 2024-06-05 EP claimed
WO-2024110922-A1 FRUIT AND VEGETABLE COATING FORMULATION, PRODUCTION METHOD AND USES OF SAME CARBOQUIMICA S.A.S (CO) 2024-05-30 WO claimed
EP-4013465-B1 TISSUE REPAIR MEMBRANE ADAPTED FOR ADHESION AND LUBRICATION, AND METHODS FOR PREPARING THE SAME AXOGEN CORP (US) 2024-05-01 EP claimed
EP-4005589-B1 A CONTROLLED RELEASE ENZYMATIC COMPOSITION AND METHODS OF USE MARIZYME INC (US) 2024-04-10 EP claimed
CN-117771328-A Antibacterial composition, wet tissue containing same and preparation method thereof 纳奇科化妆品有限公司 2024-03-29 CN claimed
EP-4337733-A2 ANTIMICROBIAL AND BIOLOGICALLY ACTIVE POLYMER COMPOSITES AND RELATED METHODS, MATERIALS, COATINGS AND DEVICES Iasis Molecular Sciences, Inc. (US) 2024-03-20 EP claimed
EP-0141628-B1 ANTIMICROBIAL LATEX COMPOSITION SHAPED ARTICLE PRODUCED THEREFROM, AND METHOD OF MANUFACTURING A SHAPED ARTICLE UNITIKA LTD. (JP) 1989-10-18 EP claimed
US-4814334-A HEXETIDINE AND CHLORHEXIDINE OR POLYHEXAMETHYLENE BIGUANIDE SALKIN ANDRE (FR) 1989-03-21 US claimed
EP-0293761-A2 Disinfecting agent and its use for disinfecting skin and surfaces of objects ALLPRO VENTURE OY (FI) 1988-12-07 EP claimed
US-4786436-A CONTAINING COLLAGEN AS A WETTING AGENT AND A BIGUANIDE AS A PRESERVATIVE BAUSCH & LOMB INCORPORATED (US) 1988-11-22 US claimed
US-4783488-A Contact lens wetting solution BAUSCH & LOMB INCORPORATED (US) 1988-11-08 US claimed
EP-0136231-B1 COMPOSITION WITH HIGH BACTERICIDAL POWER CONTAINING A BIGUANIDE AND A PYRIMIDINE Salkin, André (FR) 1988-04-20 EP claimed
EP-0252278-A2 Disinfecting agents and their use in disinfecting the skin and mucous membranes Henkel Kommanditgesellschaft auf Aktien (DE) 1988-01-13 EP claimed
US-4675347-A Antimicrobial latex composition UNITIKA LTD. (JP) 1987-06-23 US claimed
EP-0141628-A1 Antimicrobial latex composition shaped article produced therefrom, and method of manufacturing a shaped article UNITIKA LTD. (JP) 1985-05-15 EP claimed
EP-0136231-A2 Composition with high bactericidal power containing a biguanide and a pyrimidine Salkin, André (FR) 1985-04-03 EP claimed