SCHEMBL14920073

SCHEMBL14920073

CCCCOC(=O)N(C1CCCCC1)C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
ATM Q13315 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NAAA Q02083 1/20 0.39
EPHX2 P34913 1/20 0.39
TSHR P16473 4/20 0.39
HTR2A P28223 1/20 0.38
HPGD P15428 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
S1PR1 P21453 2/20 0.38
S1PR3 Q99500 2/20 0.38
XBP1 P17861 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 1/20 0.37
ESR1 P03372 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL27467689 0.83 ALDH1A1 (0.40) ALDH1A1ATMMEN1KMT2ANAAA
SCHEMBL1838694 0.83 ALDH1A1 (0.40) ALDH1A1ATMNAAAEPHX2TSHR
SCHEMBL28335632 0.82 ALDH1A1 (0.39) ALDH1A1ATMNAAAEPHX2ADH1A
SCHEMBL3317068 0.82 KMT2A (0.46) ALDH1A1ATMMEN1KMT2ATSHR
SCHEMBL6982446 0.80
SCHEMBL28177805 0.80 NAAA (0.41) ALDH1A1NAAAEPHX2TSHRADH1C
SCHEMBL9871113 0.79 PHGDH (0.40) ALDH1A1MEN1KMT2AEPHX2TSHR
SCHEMBL1835532 0.79 EPHX2 (0.42) NAAAEPHX2TSHRNPSR1MAPK1
SCHEMBL7286728 0.79 TSHR (0.37) ALDH1A1ATMNAAAEPHX2TSHR
SCHEMBL4767066 0.79 TSHR (0.37) ALDH1A1ATMNAAAEPHX2TSHR

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
WO-2013065878-A1 METHOD OF FORMING PATTERN AND COMPOSITION FOR CROSSLINKED LAYER FORMATION TO BE USED IN THE METHOD FUJIFILM CORPORATION (JP) 2013-05-10 WO disclosed