SCHEMBL6634867

SCHEMBL6634867

[CH2]CC(C(=O)O)(S(=O)(=O)O)S(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL6632576 0.80 ALDH1A1 (0.37) ALDH1A1L3MBTL1
SCHEMBL1129741 0.74 ALDH1A1 (0.42) ALDH1A1L3MBTL1
Ammonia Solution, Strong SCHEMBL11776041 0.72 ALDH1A1 (0.40) ALDH1A1L3MBTL1
SCHEMBL27549264 0.72 ALDH1A1 (0.39) ALDH1A1L3MBTL1
SCHEMBL28489478 0.72 ALDH1A1 (0.40) ALDH1A1L3MBTL1
SCHEMBL2521500 0.72 ALDH1A1 (0.40) ALDH1A1L3MBTL1
SCHEMBL27867795 0.70 ALDH1A1 (0.37) ALDH1A1L3MBTL1
SCHEMBL10887081 0.67 ALDH1A1 (0.36) ALDH1A1L3MBTL1
SCHEMBL17760613 0.67 LMNA (0.42) ALDH1A1L3MBTL1
SCHEMBL6632441 0.63 ALDH1A1 (0.46) ALDH1A1L3MBTL1

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-20040231558-A1 Has a clear hue, high light fastness and high moisture resistance MITSUI CHEMICALS, INC. (JP) 2004-11-25 US disclosed
EP-1441013-A1 WATERCOLOR INK Mitsui Chemicals, Inc. (JP) 2004-07-28 EP disclosed