SCHEMBL3359699

SCHEMBL3359699

CCCCCCCCCC[N+]1(CCO)CCNC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 3/20 0.37
GNAO1 P09471 3/20 0.37
GNAI1 P63096 3/20 0.37
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL2051662 1.00 GNAI3 (0.37) GNAI3GNAO1GNAI1LMNAALDH1A1
SCHEMBL1140661 0.89 GNAI3 (0.40) GNAI3GNAO1GNAI1
SCHEMBL7026281 0.83 GNAI3 (0.33) GNAI3GNAO1GNAI1
SCHEMBL14612159 0.79 LMNA (0.46) GNAI3GNAO1GNAI1LMNAALDH1A1
Iodide SCHEMBL4058353 0.77 GNAO1 (0.47) GNAI3GNAO1GNAI1TSHR
Iodide SCHEMBL4058357 0.76 GNAO1 (0.46) GNAI3GNAO1GNAI1TSHR
SCHEMBL7024173 0.75
Water SCHEMBL11594747 0.74 GNAO1 (0.45) GNAI3GNAO1GNAI1TSHR
Bromide SCHEMBL10753266 0.73 LMNA (0.39) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL13504734 0.73 LMNA (0.34) GNAI3GNAO1GNAI1LMNAALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1854638-B1 Reversible thermosensitive coloring material and reversible thermosensitive recording material using the same RICOH KK (JP) 2010-04-28 EP disclosed
US-7419934-B2 Reversible thermosensitive coloring material and reversible thermosensitive recording material using the reversible thermosensitive coloring material RICOH COMPANY LIMITED (JP) 2008-09-02 US disclosed
EP-1854638-A1 Reversible thermosensitive coloring material and reversible thermosensitive recording material using the same Ricoh Company, Ltd. (JP) 2007-11-14 EP disclosed
US-20070259782-A1 REVERSIBLE THERMOSENSITIVE COLORING MATERIAL AND REVERSIBLE THERMOSENSITIVE RECORDING MATERIAL USING THE REVERSIBLE THERMOSENSITIVE COLORING MATERIAL RICOH COMPANY, LIMITED (JP) 2007-11-08 US disclosed