SCHEMBL9678709

SCHEMBL9678709

CCCC1CC=NN1C(=O)NS(=O)(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 10/20 0.45
▸ STS P08842 1/20 0.40
▸ GAA P10253 1/20 0.36
▸ RIPK1 Q13546 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ PKM P14618 1/20 0.34

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
SCHEMBL9678539 0.91 HTR6 (0.49) HTR6STSGAARIPK1MAPT
SCHEMBL9677207 0.88 HTR6 (0.38) HTR6
SCHEMBL9678653 0.88 HTR6 (0.46) HTR6GAAALDH1A1POLB
SCHEMBL9676369 0.83 HTR6 (0.44) HTR6RIPK1
SCHEMBL9677235 0.82 HTR6 (0.44) HTR6STSGAARIPK1MAPT
SCHEMBL9678698 0.79 RECQL (0.39) HTR6RIPK1MAPTPOLB
SCHEMBL9678966 0.79 MAPT (0.37) HTR6GAARIPK1MAPTMEN1
SCHEMBL9677350 0.79 HTR6 (0.50) HTR6GAAALDH1A1POLB
SCHEMBL9676475 0.78 POLB (0.59) HTR6RIPK1MAPTMEN1ALDH1A1
SCHEMBL9676531 0.77 CA1 (0.41) GAAMAPTMEN1ALDH1A1KMT2A

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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