SCHEMBL21147111

SCHEMBL21147111

CC(C)[C@@H](C)N(c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 4/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
CYP2D6 P10635 2/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
FAAH O00519 3/20 0.35
MGLL Q99685 2/20 0.35
TSHR P16473 2/20 0.34
HSD17B10 Q99714 1/20 0.34
ALOX12 P18054 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL13133424 0.84 L3MBTL1 (0.50) MEN1KMT2ARAB9ANPSR1ALDH1A1
SCHEMBL13720599 0.84 L3MBTL1 (0.50) MEN1KMT2ARAB9ANPSR1ALDH1A1
SCHEMBL9312582 0.84 L3MBTL1 (0.50) MEN1KMT2ARAB9ANPSR1ALDH1A1
SCHEMBL6935203 0.84 L3MBTL1 (0.50) MEN1KMT2ARAB9ANPSR1ALDH1A1
SCHEMBL13720556 0.84 L3MBTL1 (0.50) MEN1KMT2ARAB9ANPSR1ALDH1A1
SCHEMBL15746013 0.84 L3MBTL1 (0.50) MEN1KMT2ARAB9ANPSR1ALDH1A1
SCHEMBL14069614 0.84 L3MBTL1 (0.50) MEN1KMT2ARAB9ANPSR1ALDH1A1
SCHEMBL14163852 0.84 L3MBTL1 (0.50) MEN1KMT2ARAB9ANPSR1ALDH1A1
SCHEMBL14163839 0.84 L3MBTL1 (0.50) MEN1KMT2ARAB9ANPSR1ALDH1A1
SCHEMBL19996391 0.84 L3MBTL1 (0.50) MEN1KMT2ARAB9ANPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2692796-B1 COMPOSITION SUMITOMO CHEMICAL CO (JP) 2019-07-10 EP disclosed