SCHEMBL9369233

SCHEMBL9369233

CCOC(=O)C(=Cc1ccccc1)S(=O)(=O)NC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.56
▸ KMT2A Q03164 6/20 0.56
▸ NR1H4 Q96RI1 1/20 0.44
▸ LMNA P02545 7/20 0.43
▸ MAPT P10636 6/20 0.43
▸ NPSR1 Q6W5P4 3/20 0.43
▸ CYP1A2 P05177 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ S1PR4 O95977 1/20 0.43
▸ S1PR1 P21453 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ ALDH1A1 P00352 6/20 0.41
▸ POLB P06746 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.40
▸ GAA P10253 2/20 0.40
▸ TDP1 Q9NUW8 1/20 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
SCHEMBL9366812 0.79 MEN1 (0.64) MEN1KMT2ANR1H4LMNAMAPT
SCHEMBL9836905 0.79 MEN1 (0.64) MEN1KMT2ANR1H4LMNAMAPT
SCHEMBL4909547 0.78 KMT2A (0.62) MEN1KMT2ANR1H4LMNAMAPT
SCHEMBL4909540 0.78 KMT2A (0.62) MEN1KMT2ANR1H4LMNAMAPT
SCHEMBL4901429 0.75 KMT2A (0.58) MEN1KMT2ANR1H4LMNAMAPT
SCHEMBL4901427 0.75 KMT2A (0.58) MEN1KMT2ANR1H4LMNAMAPT
Benzene SCHEMBL27988126 0.73 MEN1 (1.00) MEN1KMT2ANR1H4LMNAMAPT
SCHEMBL935186 0.73 MEN1 (1.00) MEN1KMT2ANR1H4LMNAMAPT
SCHEMBL12663988 0.73 MEN1 (0.72) MEN1KMT2ANR1H4LMNAMAPT
SCHEMBL9487714 0.72 MEN1 (0.72) MEN1KMT2ANR1H4LMNAMAPT

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-0336354-B1 Heterocyclically substituted alkyl or alkenyl ureas, methods for preparing them and their use as herbicides or plant growth regulators HOECHST SCHERING AGREVO GMBH (DE) 1994-11-02 — — EP disclosed
US-5015284-A Herbicides or plant growth regulators HOECHST AKTIENGESELLSCHAFT (DE) 1991-05-14 — — US disclosed
EP-0336354-A1 Heterocyclically substituted alkyl or alkenyl ureas, methods for preparing them and their use as herbicides or plant growth regulators Hoechst Schering AgrEvo GmbH (DE) 1989-10-11 — — EP disclosed
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