SCHEMBL6931122

SCHEMBL6931122

O=c1cc(Cl)sn1CCc1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 10/20 0.53
GSK3B P49841 2/20 0.42
DAO P14920 2/20 0.42
ALDH1A1 P00352 2/20 0.40
PRKCA P17252 1/20 0.40
ALDH2 P05091 1/20 0.38
ALDH3A1 P30838 1/20 0.38
EP300 Q09472 1/20 0.38
CREBBP Q92793 1/20 0.38
KAT2A Q92830 1/20 0.38
TAAR1 Q96RJ0 1/20 0.37

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
SCHEMBL2109583 0.87 KAT2B (0.56) KAT2BGSK3BALDH1A1PRKCAALDH2
SCHEMBL678175 0.86 KAT2B (0.58) KAT2BEP300CREBBPKAT2A
SCHEMBL3655957 0.76 ALDH1A1 (0.57) KAT2BALDH1A1EP300CREBBPKAT2A
SCHEMBL7628912 0.76 ALDH1A1 (0.51) KAT2BGSK3BDAOALDH1A1ALDH2
SCHEMBL9565202 0.74 KAT2B (0.79) KAT2BALDH1A1
SCHEMBL9854210 0.74 KAT2B (0.50) KAT2BDAOALDH1A1TAAR1
SCHEMBL11189889 0.73 KAT2B (0.77) KAT2BGSK3BALDH1A1
SCHEMBL9234887 0.73 KAT2B (0.61) KAT2B
SCHEMBL5593712 0.72 KAT2B (0.55) KAT2BGSK3BALDH1A1EP300CREBBP
SCHEMBL80967 0.72 KAT2B (0.58) KAT2BGSK3BALDH1A1PRKCA

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020128311-A1 Halocyanoacetamide antimicrobial compositions GIRONDA KEVIN F (US) 2002-09-12 US claimed
CN-1362018-A Halocyanoacetamide antimicrobial composition ROHM & HAAS (US) 2002-08-07 CN claimed
US-5073582-A MILDEW RESISTANT PAINT COMPOSITIONS COMPRISING AN ISOTHIAZOLONE AND A WATER-INSOLUBLE COPPER COMPOUND, ARTICLES, AND METHODS ROHM AND HAAS COMPANY (US) 1991-12-17 US claimed
EP-0408215-A1 Mildew resistant paint compositions ROHM AND HAAS COMPANY (US) 1991-01-16 EP claimed
EP-4227372-A1 A WHITE PAINT COMPOSITION Vecor IP Holdings Limited (HK) 2023-08-16 EP disclosed
WO-2023077174-A1 A PAINT COMPOSITION VECOR IP HOLDINGS LIMITED (CN) 2023-05-04 WO disclosed
CN-1303882-C Halocyanoacetamide antimicrobial composition ROHM & HAAS (US) 2007-03-14 CN disclosed
CN-1467255-A Stabilized coating compositions containing isothiazolone 罗姆和哈斯公司 2004-01-14 CN disclosed
US-20030232906-A1 Stabilized coating compositions containing isothiazolone GHOSH TIRTHANKAR (US) 2003-12-18 US disclosed
EP-1369461-A1 Stabilized coating compositions containing isothiazolone ROHM AND HAAS COMPANY (US) 2003-12-10 EP disclosed
US-20020128311-A1 Halocyanoacetamide antimicrobial compositions GIRONDA KEVIN F (US) 2002-09-12 US disclosed
CN-1362018-A Halocyanoacetamide antimicrobial composition ROHM & HAAS (US) 2002-08-07 CN disclosed
EP-1219172-A1 Halocyanoacetamide antimicrobial compositions ROHM AND HAAS COMPANY (US) 2002-07-03 EP disclosed
EP-0408215-A1 Mildew resistant paint compositions ROHM AND HAAS COMPANY (US) 1991-01-16 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-20020128311-A1 Halocyanoacetamide antimicrobial compositions HDHD5, DGKI, DAGLA KAT2B 1127/4885GSK3B 4664/4885DAO 1933/4885

“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.