SCHEMBL18538486

SCHEMBL18538486

CCOc1ccc(OCCOC(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.63
TDP1 Q9NUW8 1/20 0.63
MAPT P10636 4/20 0.62
ALDH1A1 P00352 2/20 0.62
LMNA P02545 2/20 0.62
SCN1A P35498 1/20 0.62
SCN2A Q99250 1/20 0.62
SCN3A Q9NY46 1/20 0.62
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
MAOB P27338 1/20 0.54
GAA P10253 1/20 0.52
THRB P10828 1/20 0.52
PARP10 Q53GL7 1/20 0.51
NPC1 O15118 1/20 0.51
MAPK1 P28482 1/20 0.50
RAB9A P51151 1/20 0.50

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
SCHEMBL18538493 0.94 MAPT (0.62) L3MBTL1TDP1MAPTALDH1A1LMNA
SCHEMBL18542254 0.91 TSHR (0.59) L3MBTL1TDP1MAPTALDH1A1LMNA
SCHEMBL11064827 0.90 ALDH1A1 (0.73) L3MBTL1TDP1MAPTALDH1A1LMNA
SCHEMBL18542252 0.89 ALDH1A1 (0.67) L3MBTL1TDP1MAPTALDH1A1LMNA
SCHEMBL14499884 0.88 NPC1 (0.61) L3MBTL1TDP1MAPTALDH1A1LMNA
SCHEMBL10758899 0.88 ESR1 (0.64) L3MBTL1TDP1MAPTALDH1A1LMNA
SCHEMBL6701399 0.87 TDP1 (0.74) L3MBTL1TDP1MAPTALDH1A1LMNA
SCHEMBL18538495 0.86 L3MBTL1 (0.55) L3MBTL1TDP1MAPTALDH1A1MEN1
SCHEMBL18538492 0.86 NPC1 (0.62) L3MBTL1TDP1MAPTLMNAGAA
SCHEMBL18538487 0.86 L3MBTL1 (0.63) L3MBTL1TDP1MAPTLMNAMEN1

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-9682594-B2 Thermochromic color-memory composition and thermochromic color-memory microcapsule pigment encapsulating same THE PILOT INK CO., LTD. (JP) 2017-06-20 US disclosed
US-20170050460-A1 THERMOCHROMIC COLOR-MEMORY COMPOSITION AND THERMOCHROMIC COLOR-MEMORY MICROCAPSULE PIGMENT ENCAPSULATING SAME THE PILOT INK CO., LTD. (JP) 2017-02-23 US disclosed