SCHEMBL13700463

SCHEMBL13700463

CC(C)(C)c1cc(CCO)cc(-n2nc3ccc(C(N)=O)cc3n2)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.37
F2R P25116 1/20 0.34
ALDH1A1 P00352 4/20 0.34
HPGD P15428 3/20 0.34
LMNA P02545 3/20 0.34
POLB P06746 1/20 0.34
THRB P10828 1/20 0.34
TSHR P16473 1/20 0.34
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 4/20 0.33
MEN1 O00255 2/20 0.32
NAMPT P43490 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
HTT P42858 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
GSR P00390 1/20 0.32
MAPK1 P28482 1/20 0.32
AGTR1 P30556 1/20 0.31

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
SCHEMBL13700455 0.90 RARG (0.36) GAAALDH1A1HPGDLMNAPOLB
SCHEMBL13700457 0.88 CYP4A11 (0.42) GAAALDH1A1HPGDLMNAKDM4E
SCHEMBL13700448 0.87 CYP4F2 (0.38) GAAALDH1A1HPGDLMNAKDM4E
SCHEMBL13700464 0.86 GAA (0.37) GAAALDH1A1HPGDLMNAKDM4E
SCHEMBL13699478 0.86 KMT2A (0.39) ALDH1A1HPGDLMNAPOLBTHRB
SCHEMBL13700466 0.84 ALDH1A1 (0.44) GAAALDH1A1HPGDLMNAPOLB
SCHEMBL13700424 0.83 JAK2 (0.33) ALDH1A1HPGDLMNAPOLBKDM4E
SCHEMBL75075 0.83 NPC1 (0.44) GAAALDH1A1HPGDLMNAPOLB
SCHEMBL30240935 0.83 NPC1 (0.44) GAAALDH1A1HPGDLMNAPOLB
SCHEMBL13699492 0.83 ERN1 (0.37) ALDH1A1HPGDLMNAPOLBKDM4E

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-8324399-B2 Heat resistance improver and reversible thermosensitive recording medium RICOH COMPANY, LTD. (JP) 2012-12-04 US disclosed
US-20090239747-A1 HEAT RESISTANCE IMPROVER AND REVERSIBLE THERMOSENSITIVE RECORDING MEDIUM RICOH COMPANY, LTD. (JP) 2009-09-24 US disclosed