SCHEMBL9958047

SCHEMBL9958047

Cc1cccc(CON=CCc2ccc(Cl)c(COC(N)=O)c2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.39
POLB P06746 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAOB P27338 2/20 0.37
TAAR1 Q96RJ0 1/20 0.35
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34
MMP12 P39900 1/20 0.34
ADRA1D P25100 1/20 0.34
HSP90AA1 P07900 1/20 0.34
CTBP2 P56545 1/20 0.34
FFAR4 Q5NUL3 2/20 0.34
ALOX15 P16050 1/20 0.34
MRGPRX4 Q96LA9 1/20 0.34
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL12466762 0.84 PPARG (0.38) IDO1POLBMEN1KMT2AMAOB
SCHEMBL9957900 0.83 DPP4 (0.37) MEN1KMT2AMRGPRX4LMNAL3MBTL1
SCHEMBL17845833 0.83 TSHR (0.42) IDO1MEN1KMT2AMAOBHSP90AA1
SCHEMBL166893 0.83 KDM4E (0.41) IDO1MEN1KMT2AMAOBHSP90AA1
SCHEMBL1274673 0.81 IDO1 (0.36) IDO1POLBMEN1KMT2AMAOB
SCHEMBL25344075 0.78 NPC1 (0.50) POLBMEN1KMT2AMAOBHSP90AA1
SCHEMBL2781697 0.78 IDO1 (0.42) IDO1POLBMEN1KMT2AMAOB
SCHEMBL7656159 0.73 IDO1 (0.59) IDO1POLBMEN1KMT2AMAOB
SCHEMBL3678882 0.70 RAB9A (0.47) POLBMEN1KMT2AMAOBHSP90AA1
SCHEMBL3678880 0.70 RAB9A (0.47) POLBMEN1KMT2AMAOBHSP90AA1

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
WO-2020206518-A1 MULTIPURPOSE BIOLOGICAL COMPOSITIONS AGRIVALLE BRASIL INDUSTRIA E COMÉRCIO DE PRODUTOS AGRÍCOLAS LTDA (BR) 2020-10-15 WO disclosed
EP-2467023-A2 BIOCONTROL MICROORGANISMS De Crecy, Eudes (US) 2012-06-27 EP disclosed