SCHEMBL9678604

SCHEMBL9678604

CC1=NN(C(=O)NS(=O)(=O)c2ccccc2F)C(c2ccccc2)C1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.56
▸ CACNA1H O95180 3/20 0.51
▸ GAA P10253 1/20 0.47
▸ KIF11 P52732 7/20 0.46
▸ LMNA P02545 1/20 0.43
▸ NT5E P21589 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TERT O14746 2/20 0.40

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
SCHEMBL9676937 0.89 RIPK1 (0.53) RIPK1CACNA1HGAAKIF11LMNA
SCHEMBL9678615 0.88 RIPK1 (0.57) RIPK1CACNA1HGAAKIF11LMNA
SCHEMBL9678365 0.87 RIPK1 (0.56) RIPK1CACNA1HGAAKIF11LMNA
SCHEMBL9678631 0.87 RIPK1 (0.56) RIPK1CACNA1HGAAKIF11LMNA
SCHEMBL9676048 0.86 RIPK1 (0.56) RIPK1CACNA1HGAAKIF11LMNA
SCHEMBL9676881 0.85 RIPK1 (0.59) RIPK1CACNA1HGAAKIF11LMNA
SCHEMBL9677317 0.85 KIF11 (0.42) RIPK1CACNA1HKIF11LMNANT5E
SCHEMBL9676811 0.84 RIPK1 (0.56) RIPK1CACNA1HGAALMNAALDH1A1
SCHEMBL9678597 0.83 RIPK1 (0.53) RIPK1CACNA1HGAAKIF11LMNA
SCHEMBL9677340 0.83 RIPK1 (0.50) RIPK1CACNA1HGAAKIF11LMNA

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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