SCHEMBL11185014

SCHEMBL11185014

CN(C)c1ccc(C2OCCN2CCNc2ccc(NCCN3CCOC3c3ccc(N(C)C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 5/20 0.39
MEN1 O00255 2/20 0.38
NSD2 O96028 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
BLM P54132 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
TOP2B Q02880 1/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 1/20 0.37
BCL2 P10415 1/20 0.37
TERT O14746 2/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 1/20 0.36
MTOR P42345 1/20 0.36
RAB9A P51151 1/20 0.36
SIRT2 Q8IXJ6 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
SCHEMBL4187405 0.93 ALDH1A1 (0.32) EHMT2MEN1KMT2AALDH1A1MAPT
SCHEMBL11179811 0.87 CYP19A1 (0.40) MEN1NSD2KMT2APOLBBLM
SCHEMBL4198995 0.83 MEN1 (0.37) MEN1NSD2KMT2APOLBBLM
SCHEMBL4186617 0.79 ALDH1A1 (0.32) MEN1NSD2KMT2ABLMALDH1A1
SCHEMBL4191344 0.78 DRD2 (0.36) KMT2AALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL4193611 0.77 SLC6A4 (0.38) MEN1KMT2APOLBKDM4EL3MBTL1
SCHEMBL11178298 0.77 CYP19A1 (0.44) MEN1NSD2KMT2APOLBBLM
SCHEMBL4200315 0.76 KDM4E (0.42) MEN1NSD2KMT2ABLMMAPT
SCHEMBL4191462 0.76 NQO1 (0.38) MEN1NSD2KMT2APOLBBLM
SCHEMBL11184786 0.75 NQO1 (0.41) MEN1NSD2KMT2APOLBBLM

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
US-4410524-A ANTITUMOR AGENTS, LEUREMIA AMERICAN CYANAMID COMPANY (US) 1983-10-18 US claimed