SCHEMBL7741981

SCHEMBL7741981

C=C(C)CC(=NOCC)C(C)=NO

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL7741976 1.00 MEN1 (0.36) MEN1KMT2ANPSR1
SCHEMBL17375382 0.80 MEN1 (0.39) MEN1KMT2ANPSR1
SCHEMBL7700253 0.80 MEN1 (0.39) MEN1KMT2ANPSR1
SCHEMBL17375381 0.80 MEN1 (0.39) MEN1KMT2ANPSR1
SCHEMBL7697882 0.78 KMT2A (0.31) KMT2A
SCHEMBL7925845 0.72 KMT2A (0.33) MEN1KMT2ANPSR1
SCHEMBL7925848 0.72 KMT2A (0.33) MEN1KMT2ANPSR1
SCHEMBL4190079 0.62
SCHEMBL7590597 0.62
SCHEMBL7693544 0.61 HTT (0.39) MEN1KMT2ANPSR1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6417388-B1 REARRANGEMENT USING BASIC OR ISOMERIZATION CATALYST BASF AKTIENGESELLSCHAFT (DE) 2002-07-09 US disclosed
EP-1131282-A1 METHOD FOR PRODUCING ALKENYL-SUBSTITUTED BIS(OXIMETHER) DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2001-09-12 EP disclosed
EP-1131284-A1 METHOD AND INTERMEDIATE PRODUCTS FOR PRODUCING BIS(OXIM)MONOETHERS BASF AKTIENGESELLSCHAFT (DE) 2001-09-12 EP disclosed
WO-2000031023-A1 METHOD FOR PRODUCING ALKENYL-SUBSTITUTED BIS(OXIMETHER) DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2000-06-02 WO disclosed
WO-2000031024-A1 METHOD AND INTERMEDIATE PRODUCTS FOR PRODUCING BIS(OXIM)MONOETHERS BASF AKTIENGESELLSCHAFT (DE) 2000-06-02 WO disclosed