SCHEMBL5665339

SCHEMBL5665339

CCC(C)C(C)Nc1ccc(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.44
ALDH1A1 P00352 7/20 0.41
L3MBTL1 Q9Y468 5/20 0.41
GAA P10253 5/20 0.41
NPSR1 Q6W5P4 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
TSHR P16473 3/20 0.41
MAPT P10636 3/20 0.41
CYP3A4 P08684 2/20 0.41
CYP1A2 P05177 1/20 0.41
MAPK1 P28482 1/20 0.41
PHLPP2 Q6ZVD8 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
THRB P10828 2/20 0.39
ALOX15 P16050 2/20 0.39
HSD17B10 Q99714 2/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 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
SCHEMBL11764680 0.74 ALDH1A1 (0.72) ALDH1A1L3MBTL1GAANPSR1TDP1
SCHEMBL19319170 0.74 SLC2A1 (0.53) SLC2A1ALDH1A1L3MBTL1GAATDP1
SCHEMBL9626237 0.73 SLC2A1 (0.71) SLC2A1ALDH1A1L3MBTL1GAATDP1
SCHEMBL61574 0.73 SLC2A1 (0.71) SLC2A1ALDH1A1L3MBTL1GAATDP1
SCHEMBL5665347 0.73 SLC2A1 (0.41) SLC2A1ALDH1A1L3MBTL1GAANPSR1
SCHEMBL16689637 0.72 SLC2A1 (0.47) SLC2A1ALDH1A1L3MBTL1GAATDP1
SCHEMBL5551150 0.72 ALDH1A1 (0.50) ALDH1A1L3MBTL1TDP1KMT2AMEN1
SCHEMBL9627045 0.72 SLC2A1 (0.55) SLC2A1ALDH1A1L3MBTL1GAANPSR1
SCHEMBL109651 0.72 SLC2A1 (0.55) SLC2A1ALDH1A1L3MBTL1GAANPSR1
SCHEMBL5010076 0.72 ALDH1A1 (0.51) SLC2A1ALDH1A1L3MBTL1KMT2AMEN1

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-20060078802-A1 Holographic storage medium SABIC INNOVATIVE PLASTICS IP B.V. 2006-04-13 US disclosed