SCHEMBL9676149

SCHEMBL9676149

O=C(NS(=O)(=O)c1ccccc1)N1N=CCC1c1ccc(Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.64
▸ HTR6 P50406 6/20 0.55
▸ RIPK1 Q13546 9/20 0.55
▸ MAPT P10636 3/20 0.55
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ ATM Q13315 1/20 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
SCHEMBL9677274 0.95 POLB (0.67) POLBHTR6RIPK1MAPTMEN1
SCHEMBL9678564 0.92 POLB (0.57) POLBHTR6RIPK1MAPTMEN1
SCHEMBL9679293 0.88 HTR6 (0.71) POLBHTR6RIPK1MAPTMEN1
SCHEMBL9677876 0.86 POLB (0.58) POLBHTR6RIPK1MAPTMEN1
SCHEMBL9676475 0.82 POLB (0.59) POLBHTR6RIPK1MAPTMEN1
SCHEMBL9676868 0.81 POLB (0.58) POLBHTR6RIPK1MAPTMEN1
SCHEMBL9678530 0.79 POLB (0.55) POLBHTR6RIPK1MAPTMEN1
SCHEMBL9676723 0.77 RIPK1 (0.52) POLBRIPK1MAPTMEN1KMT2A
SCHEMBL9676874 0.77 NPC1 (0.53) POLBHTR6RIPK1MAPTMEN1
SCHEMBL9677282 0.77 RIPK1 (0.55) POLBRIPK1MAPTMEN1KMT2A

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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