SCHEMBL7854080

SCHEMBL7854080

C=C(NCCc1c[nH]c2ccc(Cl)cc12)c1noc(Cc2ccccc2OC)n1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SNCA P37840 13/20 0.59
IDO1 P14902 1/20 0.56
ABCG2 Q9UNQ0 1/20 0.49
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
ALOX12 P18054 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TSHR P16473 1/20 0.44

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
SCHEMBL892056 0.90 SNCA (0.68) SNCAIDO1ABCG2MTNR1AMTNR1B
SCHEMBL7845319 0.89 SNCA (0.58) SNCAMTNR1AMTNR1BTSHR
SCHEMBL7852712 0.89 SNCA (0.56) SNCAMTNR1AMTNR1BLMNATSHR
SCHEMBL7845344 0.82 SNCA (0.49) SNCAMTNR1AMTNR1B
SCHEMBL892663 0.81 SNCA (0.58) SNCAABCG2MTNR1AMTNR1BMEN1
SCHEMBL891988 0.79 SNCA (0.68) SNCAMTNR1AMTNR1B
SCHEMBL892778 0.79 SNCA (0.66) SNCAMTNR1AMTNR1B
SCHEMBL892789 0.79 SNCA (0.59) SNCAABCG2
SCHEMBL892644 0.78 SNCA (0.70) SNCAIDO1ABCG2MTNR1AMTNR1B
SCHEMBL892046 0.77 SNCA (0.67) SNCA

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
WO-2010142801-A1 INDOLE AMIDE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) 2010-12-16 WO disclosed