SCHEMBL8777547

SCHEMBL8777547

CCCCN(CCCC)c1ccc(C(OC)c2ccc(N(CC)CC)cc2OCC)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 2/20 0.36
SLC16A1 P53985 2/20 0.36
ALDH1A1 P00352 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
CNR2 P34972 7/20 0.36
RXRA P19793 3/20 0.33
HNF4A P41235 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TSHR P16473 1/20 0.32
HKDC1 Q2TB90 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
SCHEMBL8777827 0.91 ALDH1A1 (0.41) ALDH1A1L3MBTL1CNR2RXRAMEN1
SCHEMBL8777694 0.91 SLC16A3 (0.36) SLC16A3SLC16A1CNR2RXRAHNF4A
SCHEMBL8777568 0.87 SLC16A3 (0.37) SLC16A3SLC16A1CNR2RXRAHNF4A
SCHEMBL8777779 0.85 S100B (0.39) SLC16A3SLC16A1ALDH1A1L3MBTL1CNR2
SCHEMBL8777842 0.85 ALDH1A1 (0.39) ALDH1A1L3MBTL1MEN1KMT2ALMNA
SCHEMBL8777634 0.84 CNR2 (0.41) SLC16A3SLC16A1ALDH1A1CNR2RXRA
SCHEMBL8777596 0.83 ALDH1A1 (0.45) ALDH1A1L3MBTL1RXRAMEN1KMT2A
SCHEMBL8777544 0.82 CNR2 (0.36) SLC16A3SLC16A1ALDH1A1L3MBTL1CNR2
SCHEMBL8777665 0.82 ALDH1A1 (0.39) ALDH1A1L3MBTL1CNR2RXRAMEN1
SCHEMBL8777735 0.82 SLC16A3 (0.41) SLC16A3SLC16A1ALDH1A1L3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0587184-B1 Pressure sensitive recording materials NEW OJI PAPER CO LTD (JP) 1997-12-29 EP disclosed
US-5478793-A Basic dye-containing layer and color accetpor-containing layer formed on same or different surfaces; basic dye enclosed in synthetic polymer microcapsules, color acceptor is activated clay containing silica KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1995-12-26 US disclosed
EP-0587184-A2 Pressure sensitive recording materials NEW OJI PAPER CO., LTD. (JP) 1994-03-16 EP disclosed