SCHEMBL6843695

SCHEMBL6843695

c1cc(-c2ccsn2)c2ocnc2c1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.33
MTNR1B P49286 3/20 0.33
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
ELANE P08246 1/20 0.32
CASP6 P55212 1/20 0.32
PDE1A P54750 1/20 0.31
PDE1B Q01064 1/20 0.31
PDE1C Q14123 1/20 0.31

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
SCHEMBL6500200 0.78 ELANE (0.41) MTNR1AMTNR1BHTR2AHTR2CELANE
SCHEMBL6049478 0.71 MTNR1A (0.33) MTNR1AMTNR1BHTR2AHTR2CELANE
SCHEMBL31427331 0.71 PDPK1 (0.41) MTNR1AMTNR1BCASP6
SCHEMBL21241351 0.70 MTNR1A (0.32) MTNR1AMTNR1BELANEPDE1APDE1B
SCHEMBL24156068 0.68 NOTUM (0.43) MTNR1AMTNR1BELANE
SCHEMBL11110191 0.68 MTNR1A (0.35) MTNR1AMTNR1BHTR2AHTR2CELANE
SCHEMBL14280235 0.67 TDP1 (0.41) MTNR1AMTNR1BELANE
SCHEMBL17231489 0.67 ALDH1A1 (0.38) MTNR1AMTNR1BHTR2AHTR2CELANE
SCHEMBL6508278 0.67 PDE4C (0.39) MTNR1AMTNR1BELANE
SCHEMBL23641593 0.66 MAPK14 (0.41) MTNR1AMTNR1BHTR2AHTR2CELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040023807-A1 3-Arylisothiazoles and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2004-02-05 US claimed
EP-1289970-A1 3-ARYLISOTHIAZOLES AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2003-03-12 EP claimed
WO-2001087863-A1 3-ARYLISOTHIAZOLES AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2001-11-22 WO claimed
US-20040023807-A1 3-Arylisothiazoles and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2004-02-05 US disclosed
EP-1289970-A1 3-ARYLISOTHIAZOLES AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2003-03-12 EP disclosed
WO-2001087863-A1 3-ARYLISOTHIAZOLES AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2001-11-22 WO 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-20040023807-A1 3-Arylisothiazoles and their use as herbicides DDT, HAX1, SULT1E1 MTNR1A 482/4885MTNR1B 483/4885HTR2A 2653/4885

“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.