SCHEMBL9679243

SCHEMBL9679243

CCSc1ccccc1S(=O)(=O)NC(=O)N1CCC=N1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 6/20 0.42
▸ ALDH1A1 P00352 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ ITGB1 P05556 1/20 0.35
▸ ITGA4 P13612 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ METAP2 P50579 3/20 0.34
▸ P2RY12 Q9H244 2/20 0.33
▸ HSD17B10 Q99714 3/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ MITF O75030 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL9678519 0.78 POLB (0.40) HTR6ALDH1A1MAPTITGB1ITGA4
SCHEMBL9676946 0.78 FLT1 (0.47) HTR6ALDH1A1P2RY12HSD17B10TSHR
SCHEMBL9677246 0.78 ITGB1 (0.48) ALDH1A1MAPTITGB1ITGA4TSHR
SCHEMBL9678815 0.77 SLC40A1 (0.47) ALDH1A1MAPT
SCHEMBL9676381 0.77 HTR6 (0.33) HTR6ITGB1ITGA4
SCHEMBL9677853 0.75 RIPK1 (0.49) HTR6ALDH1A1MAPT
SCHEMBL9679238 0.75 MEN1 (0.46) ALDH1A1
SCHEMBL9675932 0.74 CA1 (0.50) ALDH1A1SMN1; SMN2
SCHEMBL9677216 0.73 SLC40A1 (0.46) ITGB1ITGA4
SCHEMBL9678583 0.73 SLC22A12 (0.40) HTR6ALDH1A1MAPTITGB1ITGA4

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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