SCHEMBL9679249

SCHEMBL9679249

CCC1CC=NN1C(=O)NS(=O)(=O)c1ccccc1OC(F)F

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 5/20 0.34
▸ SLC22A12 Q96S37 1/20 0.34
▸ HRH1 P35367 1/20 0.34
▸ CCR3 P51677 1/20 0.34
▸ NR1I2 O75469 1/20 0.33
▸ P2RY12 Q9H244 2/20 0.33
▸ RIPK1 Q13546 4/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ SMN1; SMN2 Q16637 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
SCHEMBL9675908 0.83 POLB (0.47) HTR6RIPK1MEN1RAB9AKMT2A
SCHEMBL9677211 0.81 RECQL (0.38) HTR6RIPK1
SCHEMBL9677350 0.81 HTR6 (0.50) HTR6HRH1CCR3P2RY12ALDH1A1
SCHEMBL9677819 0.81 ALKBH2 (0.41) SLC22A12MEN1KMT2AALDH1A1LMNA
SCHEMBL9676134 0.81 CA1 (0.42) MEN1KMT2AALDH1A1LMNA
SCHEMBL9678669 0.79 HTR6 (0.51) HTR6
SCHEMBL9675912 0.77 TERT (0.35) SLC22A12NR1I2RIPK1ALDH1A1LMNA
SCHEMBL9678966 0.75 MAPT (0.37) HTR6RIPK1MEN1KMT2ALMNA
SCHEMBL9678583 0.75 SLC22A12 (0.40) HTR6SLC22A12HRH1CCR3RAB9A
SCHEMBL9678650 0.74 SLC22A12 (0.35) SLC22A12HRH1CCR3NR1I2KMT2A

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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