SCHEMBL1373686

SCHEMBL1373686

[CH2]Cc1ccc(OC)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.56
▸ KMT2A Q03164 3/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ TTR P02766 1/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ HSD17B10 Q99714 1/20 0.46
▸ CA2 P00918 1/20 0.45
▸ KDM1A O60341 1/20 0.44
▸ MAOA P21397 1/20 0.44
▸ MAOB P27338 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ GFER P55789 1/20 0.44
▸ GAA P10253 1/20 0.43
▸ CSNK2A1 P68400 3/20 0.43
▸ PPARG P37231 1/20 0.43
▸ PPARD Q03181 1/20 0.43
▸ PPARA Q07869 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ PDE5A O76074 2/20 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
SCHEMBL10349093 0.84 CA2 (0.45) ALDH1A1KMT2AMEN1TTRCA2
SCHEMBL4976340 0.83 TTR (0.67) ALDH1A1KMT2AMEN1TTRSMN1; SMN2
SCHEMBL1373688 0.82 KMT2A (0.57) ALDH1A1KMT2AMEN1TTRSMN1; SMN2
SCHEMBL217601 0.81 CA2 (0.68) ALDH1A1CA2MAPTGAAPPARG
SCHEMBL16960578 0.81 CSNK2A1 (0.51) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL13932800 0.80 KMT2A (0.56) ALDH1A1KMT2AMEN1TTRSMN1; SMN2
SCHEMBL2097147 0.80 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1TTRSMN1; SMN2
SCHEMBL7361993 0.80 SMN1; SMN2 (0.56) ALDH1A1KMT2AMEN1TTRSMN1; SMN2
SCHEMBL506373 0.80 CSNK2A1 (0.66) ALDH1A1KMT2AMEN1TTRSMN1; SMN2
SCHEMBL365268 0.80 KMT2A (0.65) ALDH1A1KMT2AMEN1TTRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960380-B2 Non-anilinic derivatives of isothiazol-3(2H)-one 1,1-dioxides as liver X receptor modulators ASTRAZENECA AB (SE) 2011-06-14 — — US claimed
US-20100227847-A1 Non-Anilinic Derivatives Of Isothiazol-3(2H)-one 1,1-Dioxides As Liver X Receptor Modulators ASTRAZENECA AB (SE) 2010-09-09 — — US claimed
US-7723333-B2 Non-anilinic derivatives of isothiazol-3(2H)-one 1,1-dioxides as liver X receptor modulators ASTRAZENECA AB (SE) 2010-05-25 — — US claimed
EP-2059516-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (publ) (SE) 2009-05-20 — — EP claimed
US-20090005353-A1 Non-Anilinic Derivatives of Isothiazol-3(2H)-one 1,1-Dioxides as Liver X Receptor Modulators ASTRAZENECA AB (SE) 2009-01-01 — — US claimed
US-20080103123-A1 New compounds BIOVITRUM (SE) 2008-05-01 — — US claimed
WO-2008025798-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 — — WO claimed
EP-1838687-A1 NON-ANILINIC DERIVATIVES OF ISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATORS AstraZeneca AB (SE) 2007-10-03 — — EP claimed
WO-2006073366-A1 NON-ANILINIC DERIVATIVES OF ISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2006-07-13 — — WO claimed
US-8791102-B2 Acetanilide sphingosine-1-phosphate receptor antagonists EXELIXIS, INC. (US) 2014-07-29 — — US disclosed
US-20110288076-A1 Sphingosine-1-Phosphate Receptor Antagonists EXELIXIS, INC. (US) 2011-11-24 — — US disclosed
EP-2346821-A1 SPHINGOSINE-1-PHOSPHATE RECEPTOR ANTAGONISTS Exelixis, Inc. (US) 2011-07-27 — — EP disclosed
US-7960380-B2 Non-anilinic derivatives of isothiazol-3(2H)-one 1,1-dioxides as liver X receptor modulators ASTRAZENECA AB (SE) 2011-06-14 — — US disclosed
US-20100227847-A1 Non-Anilinic Derivatives Of Isothiazol-3(2H)-one 1,1-Dioxides As Liver X Receptor Modulators ASTRAZENECA AB (SE) 2010-09-09 — — US disclosed
US-6967199-B2 Substituted diamine derivatives useful as motilin antagonists ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2005-11-22 — — US disclosed
EP-0120352-B1 DERIVATIVES OF N-ACYLANTHRANILIC ACIDS, PROCESS FOR THEIR PREPARATION AND THEIR USE IN COMBATING WEEDS BASF Aktiengesellschaft (DE) 1990-06-13 — — EP disclosed
EP-0078462-B1 1,2,4,6-THIATRIAZINE-1,1 DIOXIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTI-GROWTH AGENTS FOR UNWANTED PLANTS BASF Aktiengesellschaft (DE) 1986-01-15 — — EP disclosed
EP-0120352-A1 Derivatives of N-acylanthranilic acids, process for their preparation and their use in combating weeds BASF Aktiengesellschaft (DE) 1984-10-03 — — EP disclosed
US-4472191-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1984-09-18 — — US disclosed
EP-0078462-A1 1,2,4,6-Thiatriazine-1,1 dioxides, process for their preparation and their use as anti-growth agents for unwanted plants BASF Aktiengesellschaft (DE) 1983-05-11 — — 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 (4 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-20090005353-A1 Non-Anilinic Derivatives of Isothiazol-3(2H)-one 1,1-Dioxides as Liver X Receptor Modulators NR1H2, NR1H3, NR1I2 ALDH1A1 2568/4885KMT2A 2880/4885MEN1 4332/4885
US-20080103123-A1 New compounds GPR119, GPR139, GPR180 ALDH1A1 1431/4885KMT2A 4721/4885MEN1 2409/4885
US-20100227847-A1 Non-Anilinic Derivatives Of Isothiazol-3(2H)-one 1,1-Dioxides As Liver X Receptor Modulators NR1H2, NR1H3, NR1I2 ALDH1A1 2568/4885KMT2A 2880/4885MEN1 4332/4885
US-20110288076-A1 Sphingosine-1-Phosphate Receptor Antagonists S1PR1, S1PR2, S1PR3 ALDH1A1 4114/4885KMT2A 3292/4885MEN1 2389/4885

“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.

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