SCHEMBL574535

SCHEMBL574535

CCC(C)(C)c1cccc(Cl)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.43
GABRA1 P14867 2/20 0.39
GABRB2 P47870 2/20 0.39
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
HSP90AA1 P07900 1/20 0.36
TSHR P16473 2/20 0.34
MAPK14 Q16539 1/20 0.34
ALDH1A1 P00352 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALOX12 P18054 1/20 0.33
TP53 P04637 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
NR3C1 P04150 2/20 0.32
NR3C2 P08235 2/20 0.32
P2RX1 P51575 1/20 0.32
P2RX4 Q99571 1/20 0.32

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
SCHEMBL56491 0.86 CA2 (0.58) CA2GABRA1GABRB2LMNAPOLB
SCHEMBL5078077 0.85 CA2 (0.43) CA2GABRA1GABRB2LMNAPOLB
SCHEMBL20164914 0.84 ALOX5 (0.47) HSP90AA1TSHRTDP1TP53
SCHEMBL8330970 0.83 ALOX5 (0.46) HSP90AA1TSHRTDP1TP53
SCHEMBL20079592 0.81 CFD (0.35) LMNAPOLBMAPK14SMN1; SMN2NR3C1
SCHEMBL2916950 0.80 CA2 (0.71) CA2GABRA1GABRB2LMNAPOLB
SCHEMBL4493446 0.80 CA2 (0.46) CA2GABRA1GABRB2LMNATSHR
SCHEMBL9892427 0.79 CA2 (0.70) CA2GABRA1GABRB2LMNAPOLB
SCHEMBL805455 0.79 KCNN4 (0.42) LMNATSHRSMN1; SMN2HIF1AHTR2A
SCHEMBL57364 0.78 GABRA1 (0.64) CA2GABRA1GABRB2TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140135297-A1 AQUEOUS VOLATILE ORGANIC COMPOUND FREE DISINFECTANT AND/OR CLEANING COMPOSITION AND METHOD OF PREPARATION ISP INVESTMENTS INC. (US) 2014-05-15 US claimed
US-20100040565-A1 ACTIVE DELIVERY SYSTEMS FORMULATIONS Castle Beach, LLC (US) 2010-02-18 US claimed
EP-1549731-B1 CLEANING AND DISINFECTING COMPOSITION RECKITT BENCKISER INC (US) 2008-12-17 EP claimed
EP-0805672-B1 METHODS, COMPOSITIONS, AND DENTAL DELIVERY SYSTEMS FOR THE PROTECTION OF THE SURFACES OF TEETH HOMOLA ANDREW M (US) 2004-08-25 EP claimed
US-5665333-A Methods, compositions, and dental delivery systems for the protection of the surfaces of teeth PROVSEAL LLC 1997-09-09 US claimed
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
EP-4088716-B1 AN ORAL TABLET FOR INDUCED SALIVA GENERATION FERTIN PHARMA AS (DK) 2024-10-16 EP disclosed
US-12082582-B2 Synergistic preservative compositions, process for preparing the same and method of use thereof ISP INVESTMENTS LLC (US) 2024-09-10 US disclosed
WO-2024008261-A1 CANNABINOID LIPID PREMIXTURE FERTIN PHARMA A/S (DK) 2024-01-11 WO 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-5599526-A HAVING ANIONIC SURFACTANT CONTAINING A POLYOXYETHYLE ALCOHOL SULFATE AND/OR ALKALI LAURYL SULFATE, OR MIXTURE OF ALKALI LAURYL SULFATE AND AN N-ACYL-N-ALKYLTAURATE; NONCRYSTALLIZING AT LOW TEMPERTURES COLGATE-PALMOLIVE COMPANY 1997-02-04 US disclosed
US-5575652-A Process for applying antibacterial oral composition to dental implant areas COLGATE PALMOLIVE COMPANY (US) 1996-11-19 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
US-5288480-A Antiplaque antibacterial oral composition COLGATE-PALMOLIVE CO. (US) 1994-02-22 US 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
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 (2 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-12082582-B2 Synergistic preservative compositions, process for preparing the same and method of use thereof HPD, EBP, TET1 CA2 512/4885GABRA1 2818/4885GABRB2 2839/4885
US-20100040565-A1 ACTIVE DELIVERY SYSTEMS FORMULATIONS LIPA, MMP7, CTSA CA2 1688/4885GABRA1 3441/4885GABRB2 3092/4885

“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.