SCHEMBL13970293

SCHEMBL13970293

CCCCCCCCCCC(C)(N)CC

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.45
FDPS P14324 2/20 0.45
TSHR P16473 2/20 0.42
THRB P10828 1/20 0.42
DNM1 Q05193 8/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.39
EPHX1 P07099 1/20 0.39
GGPS1 O95749 1/20 0.38

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
SCHEMBL8367769 1.00 SMPD1 (0.45) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL18991574 1.00 SMPD1 (0.45) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL14149371 1.00 SMPD1 (0.45) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL14218375 1.00 SMPD1 (0.45) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL3450290 1.00 SMPD1 (0.45) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL13924928 1.00 SMPD1 (0.45) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL6899575 1.00 SMPD1 (0.45) SMPD1FDPSTSHRTHRBDNM1
Bromide SCHEMBL9422141 0.97 SMPD1 (0.43) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL8370603 0.97 FDPS (0.43) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL11608628 0.92 SMPD1 (0.34) SMPD1FDPSTSHR

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
US-20090017556-A1 METHODS AND COMPLEXES INVOLVING IMMUNOGLOBULIN MOLECULE NORTH CAROLINA A&T STATE UNIVERSITY 2009-01-15 US disclosed