SCHEMBL9676475

SCHEMBL9676475

O=C(NS(=O)(=O)c1c(Cl)cccc1Cl)N1N=CCC1c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.59
▸ RIPK1 Q13546 15/20 0.58
▸ MAPT P10636 2/20 0.58
▸ MEN1 O00255 1/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ NPC1 O15118 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ HTR6 P50406 2/20 0.51

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
SCHEMBL9676868 0.89 POLB (0.58) POLBRIPK1MAPTMEN1ALDH1A1
SCHEMBL9678530 0.89 POLB (0.55) POLBRIPK1MAPTMEN1ALDH1A1
SCHEMBL9676874 0.87 NPC1 (0.53) POLBRIPK1MAPTMEN1ALDH1A1
SCHEMBL9679126 0.86 RIPK1 (0.44) POLBRIPK1MAPTMEN1ALDH1A1
SCHEMBL9678564 0.85 POLB (0.57) POLBRIPK1MAPTMEN1ALDH1A1
SCHEMBL9677274 0.85 POLB (0.67) POLBRIPK1MAPTMEN1ALDH1A1
SCHEMBL9679293 0.84 HTR6 (0.71) POLBRIPK1MAPTMEN1ALDH1A1
SCHEMBL9677235 0.83 HTR6 (0.44) POLBRIPK1MAPTMEN1ALDH1A1
SCHEMBL9677876 0.83 POLB (0.58) POLBRIPK1MAPTMEN1ALDH1A1
SCHEMBL9676149 0.82 POLB (0.64) POLBRIPK1MAPTMEN1ALDH1A1

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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