SCHEMBL13299697

SCHEMBL13299697

CC(C)(C)c1ccccc1OC1CN(C(=O)c2ccc(N)cc2)C1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 12/20 0.60
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PLA2G1B P04054 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
CHRM3 P20309 1/20 0.40
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
DGAT2 Q96PD7 1/20 0.39

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
SCHEMBL3094503 0.90 RBP4 (0.69) RBP4MEN1KMT2APLA2G1BATG4B
SCHEMBL3100376 0.89 RBP4 (0.61) RBP4MEN1KMT2ALMNAPOLB
SCHEMBL18404361 0.89 RBP4 (0.61) RBP4MEN1KMT2ALMNAPOLB
SCHEMBL3108139 0.89 RBP4 (0.65) RBP4MEN1KMT2APLA2G1BATG4B
SCHEMBL3105986 0.87 RBP4 (0.62) RBP4MEN1KMT2ALMNAPOLB
SCHEMBL13299516 0.86 RBP4 (0.63) RBP4
SCHEMBL3107777 0.86 RBP4 (0.58) RBP4MEN1KMT2ALMNAPOLB
SCHEMBL15511167 0.85 RBP4 (0.57) RBP4MEN1KMT2APLA2G1BATG4B
SCHEMBL3113132 0.85 RBP4 (0.57) RBP4
SCHEMBL18404037 0.84 RBP4 (0.58) RBP4NPSR1PLA2G1BATG4BRXRA

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-2202223-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-06-30 EP disclosed