SCHEMBL9678539

SCHEMBL9678539

CCC1CC=NN1C(=O)NS(=O)(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 10/20 0.49
▸ STS P08842 1/20 0.41
▸ RIPK1 Q13546 3/20 0.37
▸ MAPT P10636 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ ATM Q13315 1/20 0.36
▸ SLC1A3 P43003 1/20 0.36
▸ SLC1A2 P43004 1/20 0.36
▸ GAA P10253 1/20 0.35

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
SCHEMBL9678709 0.91 HTR6 (0.45) HTR6STSRIPK1MAPTMEN1
SCHEMBL9677350 0.87 HTR6 (0.50) HTR6ALDH1A1POLBGAA
SCHEMBL9677235 0.84 HTR6 (0.44) HTR6STSRIPK1MAPTMEN1
SCHEMBL9676475 0.80 POLB (0.59) HTR6RIPK1MAPTMEN1ALDH1A1
SCHEMBL9677207 0.79 HTR6 (0.38) HTR6
SCHEMBL9678653 0.79 HTR6 (0.46) HTR6ALDH1A1POLBGAA
SCHEMBL9677211 0.78 RECQL (0.38) HTR6RIPK1MAPTPOLB
SCHEMBL9678578 0.77 HTR6 (0.49) HTR6STSATMSLC1A3SLC1A2
SCHEMBL9676134 0.76 CA1 (0.42) MAPTMEN1ALDH1A1KMT2APOLB
SCHEMBL9677819 0.76 ALKBH2 (0.41) MEN1ALDH1A1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0269141-B1 1-CARBAMOYL-2-PYRAZOLINE DERIVATIVES HAVING HERBICIDAL ACTIVITY DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1992-09-16 — — EP disclosed
US-4927452-A 1-carbonyl-2-pyrazoline derivatives having herbicidal activity DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1990-05-22 — — US disclosed
EP-0269141-A2 1-Carbamoyl-2-pyrazoline derivatives having herbicidal activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1988-06-01 — — EP disclosed
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