SCHEMBL2168406

SCHEMBL2168406

CCCCCCCCc1c(O)ccc(Cl)c1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.53
ESR1 P03372 2/20 0.43
ADRA2A P08913 2/20 0.43
ADORA3 P0DMS8 2/20 0.43
TACR2 P21452 2/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
TP53 P04637 2/20 0.43
CYP3A4 P08684 2/20 0.43
PTGS2 P35354 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
SHBG P04278 1/20 0.43
HSPD1 P10809 1/20 0.43
ADRB3 P13945 1/20 0.43
HTR2C P28335 1/20 0.43
HSPE1 P61604 1/20 0.43
HIF1A Q16665 1/20 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
SCHEMBL2166705 0.93 MAPK1 (0.46) TYRESR1CYP3A4KDM4EALOX15
SCHEMBL30081966 0.87 TYR (0.50) TYRESR1ADRA2AADORA3TACR2
SCHEMBL30081967 0.87 TYR (0.50) TYRESR1ADRA2AADORA3TACR2
SCHEMBL875815 0.87 CNR1 (0.38) TYRESR1TP53CYP3A4HIF1A
SCHEMBL10640009 0.86 TYR (0.49) TYRESR1ADRA2AADORA3TACR2
SCHEMBL8982055 0.85 TYR (0.65) TYRESR1ADRA2AADORA3TACR2
SCHEMBL10636865 0.84 TYR (0.46) TYRESR1ADRA2AADORA3TACR2
SCHEMBL9117770 0.83 TYR (0.46) TYRESR1ADRA2AADORA3TACR2
SCHEMBL10337301 0.82 TYR (0.60) TYRESR1ADRA2AADORA3TACR2
SCHEMBL3441358 0.82 TYR (0.60) TYRESR1ADRA2AADORA3TACR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3528776-B1 REDUCED-ETHANOL MOUTH RINSE FORMULATIONS KENVUE BRANDS LLC (US) 2025-11-26 EP disclosed
EP-3653303-B1 PIPETTE TIP RACK BIOTIX INC (US) 2025-02-26 EP disclosed
US-12201987-B2 Pipette tip rack BIOTIX, INC. (US) 2025-01-21 US disclosed
US-11857653-B2 Method of providing an oral care benefit using a poorly-soluble calcium compound and fluoride JOHNSON & JOHNSON CONSUMER INC. (US) 2024-01-02 US disclosed
US-11648186-B2 Coated particles and their uses JOHNSON & JOHNSON CONSUMER INC. (US) 2023-05-16 US disclosed
US-11590490-B2 Pipette tips BIOTIX, INC. (US) 2023-02-28 US disclosed
US-20220331222-A1 Method of Providing Oral Care Benefits KENVUE BRANDS LLC 2022-10-20 US disclosed
US-20220226205-A1 Coated Particles and Their Uses KENVUE BRANDS LLC 2022-07-21 US disclosed
US-11351103-B2 Method of providing oral care benefits JOHNSON & JOHNSON CONSUMER INC. (US) 2022-06-07 US disclosed
US-11291613-B2 Coated particles and their uses JOHNSON & JOHNSON CONSUMER INC. (US) 2022-04-05 US disclosed
US-5538715-A DENTIFRICES WITH ANTIPLAQUE AGENTS FOR MOUTHS WITH HUMECTANTS, SILICA POLISHES AND BACTERICIDES COLGATE PALMOLIVE COMPANY (US) 1996-07-23 US disclosed
WO-1994026245-A1 ORAL CARE COMPOSITIONS CONTAINING ZINC OXIDE PARTICLES CHURCH & DWIGHT CO., INC. (US) 1994-11-24 WO disclosed
CN-1083700-A Make the continuation method of non newtonian type cream, white shape goods COLGATE PALMOLIVE CO (US) 1994-03-16 CN disclosed
US-5288480-A Antiplaque antibacterial oral composition COLGATE-PALMOLIVE CO. (US) 1994-02-22 US disclosed
CN-1081366-A Antibacterial antiplaque oral composition COLGATE PALMOLIVE CO (US) 1994-02-02 CN disclosed
US-5192530-A Solubilizer, enhancing agent to aid retention, and delivery enhancement COLGATE-PALMOLIVE COMPANY (US) 1993-03-09 US disclosed
US-5178851-A Dentifrices treatment with triclosan and carriers COLGATE-PALMOLIVE COMPANY (US) 1993-01-12 US disclosed
US-5080887-A Polyphosphate, bactericide COLGATE-PALMOLIVE COMPANY (US) 1992-01-14 US disclosed
CN-1044047-A ANTIPLAQUE ANTIBACTERIAL ORAL COMPOSITION COLGATE PALMOLIVE CO (US) 1990-07-25 CN disclosed
US-4894220-A WATER AND ALCOHOL SOLVENTS, GLYCOL DERIVATIVES AND ESTERS SOLUTIONS COLGATE-PALMOLIVE COMPANY (US) 1990-01-16 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 (3 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-11291613-B2 Coated particles and their uses CD63, EPCAM, CD44 TYR 4307/4885ESR1 3787/4885ADRA2A 4047/4885
US-11648186-B2 Coated particles and their uses CD63, EPCAM, CD44 TYR 4307/4885ESR1 3787/4885ADRA2A 4047/4885
US-20220226205-A1 Coated Particles and Their Uses CD63, EPCAM, CD44 TYR 4307/4885ESR1 3787/4885ADRA2A 4047/4885

“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.