SCHEMBL1388718

SCHEMBL1388718

CC(NC(=O)C(C)(Cc1c[nH]c2ccccc12)N(Cc1ccccc1)C(=O)O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 18/20 0.64
TACR3 P29371 1/20 0.59
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54

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
SCHEMBL1388717 1.00 TACR1 (0.64) TACR1TACR3MEN1KMT2A
SCHEMBL8088249 0.94 TACR1 (0.66) TACR1TACR3MEN1KMT2A
SCHEMBL1388699 0.94 TACR1 (0.66) TACR1TACR3MEN1KMT2A
SCHEMBL1388541 0.94 TACR1 (0.61) TACR1TACR3
SCHEMBL1388491 0.94 TACR1 (0.67) TACR1TACR3
SCHEMBL1388826 0.94 TACR1 (0.57) TACR1TACR3
SCHEMBL1388825 0.94 TACR1 (0.57) TACR1TACR3
SCHEMBL8198447 0.94 TACR1 (0.67) TACR1TACR3
SCHEMBL1388516 0.92 TACR1 (0.56) TACR1TACR3
SCHEMBL1388518 0.92 TACR1 (0.56) TACR1TACR3

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
JP-H08500361-A 1996-01-16 JP claimed