SCHEMBL4813329

SCHEMBL4813329

CC(C)NCCNc1ccccc1.c1cc2ccc1-2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TDP1 Q9NUW8 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
KAT2B Q92831 1/20 0.41
CTSK P43235 1/20 0.39
FNTA P49354 1/20 0.39
FNTB P49356 1/20 0.39
CYP3A4 P08684 2/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
ALOX12 P18054 1/20 0.38
RECQL P46063 1/20 0.38
ATM Q13315 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 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
SCHEMBL4813312 0.94 FNTA (0.45) MAPTALDH1A1KAT2BCTSKFNTA
SCHEMBL18236672 0.94 MAPT (0.54) MAPTALDH1A1TDP1L3MBTL1KAT2B
SCHEMBL2421711 0.78 CTSK (0.48) ALDH1A1CTSKFNTAFNTBCYP3A4
SCHEMBL23330357 0.77 ALDH1A1 (0.48) MAPTALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL15083052 0.76 MAPT (0.46) MAPTALDH1A1KAT2BCYP3A4THRB
SCHEMBL232188 0.76 MAPT (0.78) MAPTALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL14387512 0.74 MAPT (0.45) MAPTALDH1A1TDP1L3MBTL1KAT2B
SCHEMBL10850136 0.74 MAPT (0.45) MAPTALDH1A1CTSKRECQLCYP1A2
SCHEMBL6416019 0.73 MAPT (0.74) MAPTALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL1562142 0.73 MAPT (0.74) MAPTALDH1A1TDP1L3MBTL1CYP3A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7437108-B2 Developing roller for electrographic apparatus including a base rubber, a conductive polymer, a conductive carbon black and a binder resin and electrographic apparatus containing the developing roller SAMSUNG ELECTRONICS CO., LTD. (KR) 2008-10-14 US disclosed
US-20050220502-A1 Developing roller for electrographic apparatus and electrographic apparatus comprising the same SAMSUNG ELECTRONICS CO., LTD. 2005-10-06 US disclosed