SCHEMBL1595027

SCHEMBL1595027

CCCCCN(CCCCC)c1ccc(C(=O)C(CC)(Cc2ccccc2)N(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.43
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42
MLYCD O95822 1/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
EGFR P00533 2/20 0.38
ERBB2 P04626 2/20 0.38
PTGES O14684 2/20 0.37
ALOX5 P09917 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
NPC1 O15118 1/20 0.36
JAK2 O60674 1/20 0.36
RAB9A P51151 1/20 0.36
PAX8 Q06710 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL20074485 0.92 CNR2 (0.44) CNR2NR1H2NR1H3MLYCDEGFR
SCHEMBL13310003 0.88 MLYCD (0.41) CNR2NR1H2NR1H3MLYCDEGFR
SCHEMBL58499 0.84 KMT2A (0.51) CNR2MLYCDKDM4EALDH1A1NPC1
Benzene SCHEMBL28672020 0.82 RIPK1 (0.43) MLYCDNPC1RAB9A
SCHEMBL4650526 0.82 RIPK1 (0.43) MLYCDNPC1RAB9A
SCHEMBL22039927 0.82 MLYCD (0.38) CNR2NR1H2NR1H3MLYCDEGFR
SCHEMBL3421882 0.81 L3MBTL1 (0.47) MLYCDALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL8898604 0.81 SRD5A1 (0.47) MLYCDEGFRERBB2ALDH1A1RAB9A
SCHEMBL23507905 0.80 MLYCD (0.45) CNR2NR1H2NR1H3MLYCDTHRA
SCHEMBL4651747 0.80 NPC1 (0.41) MLYCDKDM4EALDH1A1POLBNPC1

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-2130881-B1 Pigment dispersion and ink composition using the same FUJIFILM CORP (JP) 2011-11-09 EP disclosed
US-7919545-B2 Pigment dispersion and ink composition using the same FUJIFILM CORPORATION (JP) 2011-04-05 US disclosed
US-20100137509-A1 PIGMENT DISPERSION AND INK COMPOSITION USING THE SAME FUJIFILM CORPORATION (JP) 2010-06-03 US disclosed
EP-2130881-A1 Pigment dispersion and ink composition using the same FUJIFILM Corporation (JP) 2009-12-09 EP disclosed