SCHEMBL9676274

SCHEMBL9676274

COC(=O)c1ccccc1S(=O)(=O)NC(=O)N1N=CC(C)C1C

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA5A P35218 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ SLC40A1 Q9NP59 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ BRD4 O60885 2/20 0.39
▸ RIPK1 Q13546 1/20 0.38
▸ PTPN2 P17706 1/20 0.37
▸ PTPN1 P18031 1/20 0.37
▸ PTPN5 P54829 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37

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
SCHEMBL9676059 0.87 CA1 (0.42) CA1CA2CA5ACA9KMT2A
SCHEMBL9678301 0.87 CA1 (0.42) CA1CA2CA5ACA9KMT2A
SCHEMBL9678700 0.82 HTR6 (0.46) CA1CA2CA9NPC1GAA
SCHEMBL9677191 0.81 CA1 (0.45) CA1CA2CA5ACA9KMT2A
SCHEMBL9678734 0.78 CA1 (0.45) CA1CA2CA5ACA9KMT2A
SCHEMBL9676134 0.76 CA1 (0.42) CA1CA2CA5ACA9KMT2A
SCHEMBL9678822 0.76 RIPK1 (0.54) KMT2AMEN1NPC1POLBALDH1A1
SCHEMBL30754377 0.75 CA1 (0.63) CA1CA2CA5ACA9KMT2A
SCHEMBL9678294 0.74 HTR6 (0.53) CA1CA2CA5ACA9
SCHEMBL9676531 0.74 CA1 (0.41) CA1CA2CA5ACA9KMT2A

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 6 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 claimed
US-4927452-A 1-carbonyl-2-pyrazoline derivatives having herbicidal activity DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1990-05-22 — — US claimed
EP-0269141-A2 1-Carbamoyl-2-pyrazoline derivatives having herbicidal activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1988-06-01 — — EP claimed
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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