SCHEMBL9676946

SCHEMBL9676946

O=C(NS(=O)(=O)c1ccccc1Cl)N1CCC=N1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT1 P17948 1/20 0.47
▸ FLT4 P35916 1/20 0.47
▸ KDR P35968 1/20 0.47
▸ HTR6 P50406 3/20 0.45
▸ HRH1 P35367 1/20 0.44
▸ CCR3 P51677 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ GAA P10253 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ P2RY12 Q9H244 1/20 0.42
▸ CA12 O43570 4/20 0.40
▸ CA1 P00915 4/20 0.40
▸ CA2 P00918 4/20 0.40
▸ CA9 Q16790 4/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ SLC40A1 Q9NP59 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PKM P14618 1/20 0.39
▸ CA4 P22748 2/20 0.39

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
SCHEMBL9676453 0.85 HTR6 (0.45) HTR6POLBGAASLC40A1L3MBTL1
SCHEMBL9678519 0.84 POLB (0.40) HTR6POLBCA1CA2ALDH1A1
SCHEMBL9677246 0.81 ITGB1 (0.48) HRH1CCR3POLBTSHRALDH1A1
SCHEMBL9679238 0.81 MEN1 (0.46) ALDH1A1SLC40A1
SCHEMBL9675932 0.80 CA1 (0.50) GAACA1CA2ALDH1A1SLC40A1
SCHEMBL9678815 0.80 SLC40A1 (0.47) POLBGAACA1CA2CA9
SCHEMBL9678583 0.78 SLC22A12 (0.40) HTR6HRH1CCR3ALDH1A1
SCHEMBL9679243 0.78 HTR6 (0.42) HTR6TSHRHSD17B10P2RY12ALDH1A1
SCHEMBL9677216 0.78 SLC40A1 (0.46) SLC40A1
SCHEMBL9679153 0.77 HTR6 (0.42) FLT1FLT4KDRHTR6SLC40A1

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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