SCHEMBL9678806

SCHEMBL9678806

O=C(NS(=O)(=O)c1c(Cl)cccc1Cl)N1N=C(C2CC2)CC1c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 7/20 0.42
▸ STS P08842 1/20 0.41
▸ EGFR P00533 1/20 0.38
▸ CNR1 P21554 3/20 0.38
▸ CNR2 P34972 2/20 0.37
▸ YAP1 P46937 1/20 0.37
▸ TEAD4 Q15561 1/20 0.37
▸ RIPK1 Q13546 1/20 0.36
▸ HTR6 P50406 1/20 0.36
▸ MAOA P21397 1/20 0.35
▸ MAOB P27338 1/20 0.35

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
SCHEMBL9676962 0.90 KIF11 (0.44) KIF11EGFRCNR1RIPK1HTR6
SCHEMBL9678694 0.88 KIF11 (0.44) KIF11RIPK1
SCHEMBL9676928 0.86 CNR1 (0.42) KIF11CNR1CNR2RIPK1
SCHEMBL9679224 0.84 RIPK1 (0.54) KIF11STSEGFRRIPK1HTR6
SCHEMBL9678347 0.82 KIF11 (0.42) KIF11CNR1RIPK1
SCHEMBL9677317 0.82 KIF11 (0.42) KIF11RIPK1
SCHEMBL9678774 0.79 ALKBH2 (0.41) KIF11RIPK1
SCHEMBL9678797 0.79 RIPK1 (0.40) RIPK1
SCHEMBL9676475 0.77 POLB (0.59) RIPK1HTR6
SCHEMBL9676007 0.77 RIPK1 (0.36) KIF11RIPK1

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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