SCHEMBL19038366

SCHEMBL19038366

CCOC(=O)C(=Cc1ccc(N(c2ccc(C)cc2)c2ccc(/C=C(\C(C)=O)C(=O)OCC)cc2)cc1)C(=O)OCC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 11/20 0.59
MEN1 O00255 9/20 0.59
MAPT P10636 11/20 0.58
LMNA P02545 5/20 0.58
NPSR1 Q6W5P4 2/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
S1PR4 O95977 1/20 0.58
S1PR1 P21453 1/20 0.58
MAPK1 P28482 1/20 0.58
KDM4E B2RXH2 5/20 0.55
ALDH1A1 P00352 5/20 0.55
HSP90AA1 P07900 3/20 0.55
HPGD P15428 1/20 0.55
GLO1 Q04760 2/20 0.52
NR1H4 Q96RI1 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
MITF O75030 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL7945104 0.94 MEN1 (0.66) KMT2AMEN1MAPTLMNANPSR1
SCHEMBL19049494 0.94 MEN1 (0.66) KMT2AMEN1MAPTLMNANPSR1
SCHEMBL10890387 0.91 KMT2A (0.65) KMT2AMEN1MAPTLMNANPSR1
SCHEMBL10890390 0.91 KMT2A (0.65) KMT2AMEN1MAPTLMNANPSR1
SCHEMBL11547023 0.91 KMT2A (0.65) KMT2AMEN1MAPTLMNANPSR1
SCHEMBL21183312 0.90 MEN1 (0.72) KMT2AMEN1MAPTLMNANPSR1
SCHEMBL15095092 0.87 MEN1 (0.77) KMT2AMEN1MAPTLMNANPSR1
SCHEMBL11434906 0.86 KMT2A (0.58) KMT2AMEN1MAPTLMNANPSR1
SCHEMBL7273126 0.82 KMT2A (0.87) KMT2AMEN1MAPTLMNANPSR1
SCHEMBL12913257 0.82 KMT2A (0.87) KMT2AMEN1MAPTLMNANPSR1

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
US-20170184987-A1 PHOTOCONDUCTOR OVERCOAT HAVING CROSSLINKABLE HOLE TRANSPORT MOLECULES HAVING FOUR RADICAL POLYMERIZBLE GROUPS AND METHOD TO MAKE THE SAME LEXMARK INTERNATIONAL, INC. 2017-06-29 US disclosed
US-20170184984-A1 PHOTOCONDUCTOR HAVING CROSSLINKABLE TRANSPORT MOLECULES HAVING FOUR RADICAL POLYMERIZABLE GROUPS AND METHOD TO MAKE THE SAME LEXMARK INTERNATIONAL, INC. 2017-06-29 US disclosed
US-20170184986-A1 PHOTOCONDUCTOR OVERCOAT HAVING CROSSLINKABLE HOLE TRANSPORT MOLECULES HAVING FOUR RADICAL POLYMERIZBLE GROUPS AND METHOD TO MAKE THE SAME LEXMARK INTERNATIONAL, INC. 2017-06-29 US disclosed
US-20170184985-A1 PHOTOCONDUCTOR HAVING CROSSLINKABLE TRANSPORT MOLECULES HAVING FOUR RADICAL POLYMERIZABLE GROUPS AND METHOD TO MAKE THE SAME LEXMARK INTERNATIONAL, INC. 2017-06-29 US disclosed