SCHEMBL10030184

SCHEMBL10030184

CCC(C)C(=O)OCCOc1ccc(OCCOC(C)=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ PDE3B Q13370 1/20 0.40
▸ PDE3A Q14432 1/20 0.40
▸ P2RY12 Q9H244 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40

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
SCHEMBL27652847 0.87 LTA4H (0.49) MEN1KMT2ATDP1MAPTSMN1; SMN2
SCHEMBL6721427 0.85 THRB (0.53) ALDH1A1MEN1KMT2ATDP1L3MBTL1
SCHEMBL11941089 0.84 MAPK1 (0.60) TDP1TP53MAPK1
SCHEMBL762624 0.84 TP53 (0.56) TP53
SCHEMBL10030181 0.84 L3MBTL1 (0.55) ALDH1A1MEN1KMT2AL3MBTL1GAA
SCHEMBL13528733 0.84 ALDH1A1 (0.52) ALDH1A1L3MBTL1GAASMN1; SMN2
SCHEMBL12347968 0.83 ALDH1A1 (0.57) ALDH1A1MAPT
SCHEMBL11991307 0.83 KMT2A (0.45) ALDH1A1MEN1KMT2ATDP1L3MBTL1
SCHEMBL19680357 0.81 TDP1 (0.49) ALDH1A1MEN1KMT2ATDP1NPSR1
SCHEMBL12032774 0.81 TDP1 (0.49) ALDH1A1MEN1KMT2ATDP1NPSR1

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-8277696-B2 Thermochromic color-memory composition, and thermochromic color-memory microcapsule pigment having the composition encapsulated therein THE PILOT INK CO., LTD. (JP) 2012-10-02 — — US disclosed
US-20120049139-A1 THERMOCHROMIC COLOR-MEMORY COMPOSITION, AND THERMOCHROMIC COLOR-MEMORY MICROCAPSULE PIGMENT HAVING THE COMPOSITION ENCAPSULATED THEREIN THE PILOT INK CO., LTD. (JP) 2012-03-01 — — US disclosed
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