SCHEMBL9675908

SCHEMBL9675908

O=C(NS(=O)(=O)c1ccccc1OC(F)F)N1N=CCC1c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.47
▸ RIPK1 Q13546 14/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ MAPT P10636 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CASP3 P42574 1/20 0.42
▸ SENP8 Q96LD8 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42
▸ SENP6 Q9GZR1 1/20 0.42
▸ HTR6 P50406 2/20 0.42

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
SCHEMBL9676073 0.86 L3MBTL1 (0.53) POLBRIPK1NPC1RAB9AMAPT
SCHEMBL9678331 0.86 RIPK1 (0.49) POLBRIPK1NPC1RAB9AMAPT
SCHEMBL9679249 0.83 HTR6 (0.34) RIPK1RAB9AALDH1A1MEN1KMT2A
SCHEMBL9676723 0.83 RIPK1 (0.52) POLBRIPK1NPC1RAB9AMAPT
SCHEMBL9677340 0.82 RIPK1 (0.50) RIPK1ALDH1A1
SCHEMBL9677282 0.81 RIPK1 (0.55) POLBRIPK1NPC1RAB9AMAPT
SCHEMBL9677567 0.81 RIPK1 (0.55) POLBRIPK1NPC1RAB9AMAPT
SCHEMBL9676868 0.81 POLB (0.58) POLBRIPK1NPC1RAB9AMAPT
SCHEMBL9676497 0.81 RIPK1 (0.52) POLBRIPK1NPC1RAB9AMAPT
SCHEMBL9678289 0.81 KIF11 (0.36) RIPK1ALDH1A1

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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