SCHEMBL9676571

SCHEMBL9676571

CC1=NN(C(=O)NS(=O)(=O)c2c(F)cccc2F)C(C)(C)C1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.38
▸ KAT6A Q92794 3/20 0.37
▸ KIF11 P52732 1/20 0.34
▸ PKM P14618 4/20 0.33
▸ PKLR P30613 1/20 0.33
▸ CCKBR P32239 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ SLC40A1 Q9NP59 1/20 0.32
▸ HSD11B1 P28845 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ LMNA P02545 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
SCHEMBL9677170 0.87 EDNRA (0.40) POLBKAT6A
SCHEMBL9677074 0.85 STS (0.40) POLBPKMMEN1KMT2AGAA
SCHEMBL9678590 0.79 PKM (0.34) KAT6APKMPKLRCCKBRSLC40A1
SCHEMBL9678308 0.78 FLT1 (0.33) POLBHSD11B1LMNA
SCHEMBL9678305 0.77 FLT1 (0.43) POLBGAA
SCHEMBL9677307 0.75 HTR6 (0.43) KAT6APKMPKLRCCKBRSLC40A1
SCHEMBL9676037 0.74 CA1 (0.44) POLBMEN1KMT2ASLC40A1GAA
SCHEMBL9676160 0.74 ALPL (0.39) PIK3CASLC40A1HSD11B1
SCHEMBL9676148 0.74 SLC22A12 (0.35) POLBMEN1KMT2AGAALMNA
SCHEMBL9678657 0.73 CACNA1H (0.39) KAT6AKIF11PKMPKLRCCKBR

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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