Benzene

Benzene

SCHEMBL573759

CCc1c(O)ccc(Cl)c1C.c1ccccc1

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 4/20 0.37
ESR1 P03372 3/20 0.37
CYP3A4 P08684 1/20 0.37
MAPK1 P28482 1/20 0.37
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
SHBG P04278 1/20 0.34
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
TP53 P04637 2/20 0.33
TRPA1 O75762 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL664026 0.96 CYP3A4 (0.39) ESR2ESR1CYP3A4MAPK1ALDH1A1
SCHEMBL875815 0.80 CNR1 (0.38) ESR2ESR1CYP3A4MAPK1HPGD
SCHEMBL560333 0.79 MEN1 (0.46) CYP3A4MAPK1ALDH1A1KDM4EGLA
SCHEMBL4407869 0.79 CYP3A4 (0.39) ESR2ESR1CYP3A4MAPK1ALDH1A1
SCHEMBL2166705 0.78 MAPK1 (0.46) ESR2ESR1CYP3A4MAPK1KDM4E
SCHEMBL648577 0.78 ESR1 (0.47) ESR2ESR1ALDH1A1KDM4EGLA
SCHEMBL11891680 0.78 ALDH1A1 (0.36) ALDH1A1TP53CYP2C9CYP2C19SMN1; SMN2
SCHEMBL29810179 0.78 HPGD (0.45) CYP3A4ALDH1A1KDM4EGAAHPGD
SCHEMBL573758 0.78 HPGD (0.45) CYP3A4ALDH1A1KDM4EGAAHPGD
SCHEMBL23227095 0.77 CYP3A4 (0.52) ESR2ESR1CYP3A4MAPK1ALDH1A1

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 151 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
WO-2012170841-A1 AN AQUEOUS VOLATILE ORGANIC COMPOUND FREE DISINFECTANT AND/OR CLEANING COMPOSITION AND METHOD OF PREPARATION ISP INVESTMENTS INC. (US) 2012-12-13 WO claimed
EP-2313026-A1 ACTIVE DELIVERY SYSTEM FORMULATIONS Castle Beach, L.L.C. (US) 2011-04-27 EP claimed
US-20100040565-A1 ACTIVE DELIVERY SYSTEMS FORMULATIONS Castle Beach, LLC (US) 2010-02-18 US claimed
WO-2010019680-A1 ACTIVE DELIVERY SYSTEM FORMULATIONS HOMOLA ANDREW M (US) 2010-02-18 WO 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
WO-1994026245-A1 ORAL CARE COMPOSITIONS CONTAINING ZINC OXIDE PARTICLES CHURCH & DWIGHT CO., INC. (US) 1994-11-24 WO 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 ESR2 2562/4885ESR1 1103/4885CYP3A4 1165/4885
US-20100040565-A1 ACTIVE DELIVERY SYSTEMS FORMULATIONS LIPA, MMP7, CTSA ESR2 1097/4885ESR1 1163/4885CYP3A4 1524/4885

“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.