SCHEMBL23375445

SCHEMBL23375445

CCCC(CC)NC1CCCCCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.41
KDM4E B2RXH2 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
EPHX1 P07099 2/20 0.37
SLC6A4 P31645 1/20 0.37
ALDH1A1 P00352 3/20 0.35
EPHX2 P34913 2/20 0.35
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
S100A4 P26447 1/20 0.34
RECQL P46063 1/20 0.34
RAB9A P51151 1/20 0.34
GALK1 P51570 1/20 0.34
BLM P54132 1/20 0.34
CASP6 P55212 1/20 0.34
KMT2A Q03164 1/20 0.34
IDO1 P14902 1/20 0.34
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL9885785 1.00 SHBG (0.41) SHBGKDM4ESMN1; SMN2EPHX1SLC6A4
SCHEMBL24783446 0.94 SLC6A4 (0.38) SHBGKDM4ESMN1; SMN2EPHX1SLC6A4
SCHEMBL16919669 0.91 SMN1; SMN2 (0.41) SHBGKDM4ESMN1; SMN2EPHX1ALDH1A1
SCHEMBL11055827 0.88 SIGMAR1 (0.39) SHBGKDM4EEPHX1EPHX2MEN1
SCHEMBL1148861 0.87 KDM4E (0.50) SHBGKDM4EEPHX1SLC6A4ALDH1A1
SCHEMBL7775156 0.87 KDM4E (0.50) SHBGKDM4EEPHX1SLC6A4ALDH1A1
SCHEMBL11058665 0.86 EPHX1 (0.40) SHBGKDM4EEPHX1EPHX2MEN1
SCHEMBL28785546 0.85 SIGMAR1 (0.42) SHBGKDM4EEPHX1ALDH1A1EPHX2
Ammonia Solution, Strong SCHEMBL342936 0.85 KDM4E (0.48) SHBGKDM4EEPHX1SLC6A4ALDH1A1
SCHEMBL7776985 0.84 KDM4E (0.52) SHBGKDM4EEPHX1SLC6A4ALDH1A1

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-20210147959-A1 PROCESS FOR DRY BENEFICIATION OF BAUXITE MINERALS BY ELECTROSTATIC SEGREGATION ST EQUIPMENT & TECHNOLOGY LLC 2021-05-20 US disclosed