SCHEMBL1904032

SCHEMBL1904032

CC(CCO)CC(O)C(O)CC(C)CCO

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.45
ALDH1A1 P00352 2/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 3/20 0.39
THRB P10828 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.32
TRPV1 Q8NER1 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
SCHEMBL19327340 0.86 TSHR (0.46) TRPA1ALDH1A1ALOX15TSHRTHRB
SCHEMBL9317504 0.86 TRPA1 (0.38) TRPA1ALDH1A1ALOX15TSHRLMNA
SCHEMBL8604366 0.84 TRPA1 (0.50) TRPA1ALDH1A1ALOX15TSHRTHRB
SCHEMBL2487460 0.84 TRPA1 (0.41) TRPA1ALDH1A1ALOX15TSHRLMNA
SCHEMBL8145533 0.83 TRPA1 (0.38) TRPA1ALDH1A1ALOX15TSHRLMNA
SCHEMBL6882428 0.83 LMNA (0.43) TRPA1ALDH1A1ALOX15TSHRTHRB
SCHEMBL25275377 0.82
SCHEMBL15978700 0.82
SCHEMBL13210551 0.82
SCHEMBL342469 0.82

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-7937026-B2 Liquid developing electrophotographic device roller and liquid developing electrophotographic device BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2011-05-03 US disclosed
US-20090290909-A1 Liquid Developing Electrophotographic Device Roller and Liquid Developing Electrophotographic Device BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2009-11-26 US disclosed