SCHEMBL28078039

SCHEMBL28078039

O=C(Cc1ccccc1)N1CCNCC1N1CCNCC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HSD11B1 P28845 1/20 0.44
MC4R P32245 2/20 0.44
MC3R P41968 2/20 0.44
MC1R Q01726 2/20 0.44
HPGD P15428 1/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA4 P22748 2/20 0.43
CA9 Q16790 2/20 0.43
PARP1 P09874 1/20 0.43
USP2 O75604 1/20 0.43
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.43
DPP4 P27487 1/20 0.42

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
SCHEMBL1713559 0.81 DPP4 (0.54) ALDH1A1L3MBTL1HSD11B1HPGDCA1
SCHEMBL1677885 0.80 L3MBTL1 (0.44) ALDH1A1KDM4EL3MBTL1HSD11B1MC4R
SCHEMBL92506 0.78 L3MBTL1 (0.63) ALDH1A1KDM4EL3MBTL1HSD11B1HPGD
SCHEMBL1714121 0.78 DPP4 (0.57) ALDH1A1KDM4EL3MBTL1HSD11B1HPGD
SCHEMBL3721248 0.77 POLB (0.60) ALDH1A1KDM4EPARP1GAA
Hydrochloric Acid SCHEMBL20337874 0.77 L3MBTL1 (0.61) ALDH1A1KDM4EL3MBTL1HSD11B1HPGD
SCHEMBL9090627 0.77 L3MBTL1 (0.61) ALDH1A1KDM4EL3MBTL1HSD11B1HPGD
Methyl Alcohol SCHEMBL10623350 0.75 HSD11B1 (0.64) ALDH1A1KDM4EL3MBTL1HSD11B1HPGD
SCHEMBL8672473 0.73 L3MBTL1 (0.56) ALDH1A1KDM4EL3MBTL1HSD11B1HPGD
SCHEMBL28078229 0.72 SIGMAR1 (0.49) GAA

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
CN-104046246-B The chemical-mechanical planarization of tungsten-containing substrate 气体产品与化学公司 2016-06-15 CN disclosed