SCHEMBL8447906

SCHEMBL8447906

NC(=O)OC1=C(OC(N)=O)CCCC1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL10443840 0.76 MEN1 (0.34) MEN1KMT2A
SCHEMBL582217 0.74 KDM4E (0.30)
SCHEMBL7531500 0.72 PGR (0.42)
SCHEMBL10443600 0.72
SCHEMBL15321785 0.70
SCHEMBL11528045 0.67 HDAC4 (0.38) MEN1KMT2A
SCHEMBL9648799 0.67 ESR1 (0.38) MEN1KMT2A
SCHEMBL5594162 0.63 MEN1 (0.48) MEN1KMT2A
SCHEMBL21464342 0.62
SCHEMBL18489316 0.62 ESR1 (0.35) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0637298-B1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF AG (DE) 1999-03-31 EP disclosed
WO-1993022280-A1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF AKTIENGESELLSCHAFT (DE) 1993-11-11 WO disclosed