SCHEMBL12192029

SCHEMBL12192029

CO/C=C/CCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
MAPT P10636 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HSD17B10 Q99714 1/20 0.50
BCHE P06276 2/20 0.49
ACHE P22303 2/20 0.49
MAOB P27338 2/20 0.49
CHRM2 P08172 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL23810456 0.82 CHRM2 (0.53) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL4581242 0.80 TDP1 (0.59) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL28449486 0.80 TDP1 (0.59) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL2820639 0.80 CDC25A (0.50) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL24769921 0.79 TDP1 (0.50) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL8332454 0.78 CHRM2 (0.56) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL8326959 0.78 TDP1 (0.49) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL6214684 0.78 TDP1 (0.49) MEN1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL16882232 0.78 TDP1 (0.53) MEN1KMT2ACHRM2CYP1A2CYP2C19
SCHEMBL30903165 0.78 TDP1 (0.49) MEN1KMT2AMAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1200484-B1 METHODS AND REAGENTS MAKING MULTIVALENT ARRAYS AND COMBINATORIAL LIBRARIES OF MULTIVALENT ARRAYS WISCONSIN ALUMNI RES FOUND (US) 2011-10-05 EP disclosed