Dimethylamine

Dimethylamine

SCHEMBL7572333

CCCCOc1cc(-c2ccccc2)c(OCCCC)c(C#N)c1C#N.CNC

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
CD274 Q9NZQ7 1/20 0.39
PIM1 P11309 3/20 0.38
ADRB2 P07550 1/20 0.37
CDC7 O00311 1/20 0.37
PLK4 O00444 1/20 0.37
CHEK1 O14757 1/20 0.37
CHUK O15111 1/20 0.37
PDPK1 O15530 1/20 0.37
DYRK3 O43781 1/20 0.37
ROCK2 O75116 1/20 0.37
PRKD3 O94806 1/20 0.37
MAP4K4 O95819 1/20 0.37
PAK4 O96013 1/20 0.37
NTRK1 P04629 1/20 0.37
PRKCG P05129 1/20 0.37
INSR P06213 1/20 0.37
LCK P06239 1/20 0.37
FYN P06241 1/20 0.37
CDK1 P06493 1/20 0.37

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
SCHEMBL7573073 0.96 KDM4E (0.39) KDM4EPIM1ADRB2MAPK1ALDH1A1
SCHEMBL7715410 0.89 L3MBTL1 (0.39) KDM4EPIM1MAPK1ALDH1A1SMN1; SMN2
SCHEMBL7572253 0.84 CYP3A4 (0.46) KDM4EPIM1CDC7ROCK2MAP4K4
SCHEMBL7573743 0.84 MAPT (0.41) KDM4EMAPK1ALDH1A1SMN1; SMN2SQOR
SCHEMBL7580611 0.84 MAPT (0.44) KDM4EPIM1ALDH1A1SMN1; SMN2SQOR
SCHEMBL7575694 0.82 CNR2 (0.39) CD274ALDH1A1PTPN11MAPTHPGD
SCHEMBL7575492 0.82 RARB (0.55) ALDH1A1PTPN11HPGD
SCHEMBL7573733 0.82 GRM2 (0.41) KDM4ECD274MAPK1SQORCYP1A2
SCHEMBL7572329 0.81 PIM1 (0.41) KDM4EPIM1MAPK1ALDH1A1SMN1; SMN2
SCHEMBL7572249 0.79 CYP1A2 (0.46) KDM4EMAPK1ALDH1A1SMN1; SMN2SQOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002096913-A1 SUBSTITUTED DI(HYDROXY/ALKOXY)SILICON PHTHALOCYANINES AND THEIR USES GENTIAN AS (NO) 2002-12-05 WO disclosed
EP-1238016-A1 SUBSTITUTED PHTHALOCYANINES AND THEIR PRECURSORS Gentian AS (NO) 2002-09-11 EP disclosed
WO-2001042368-A1 SUBSTITUTED PHTHALOCYANINES AND THEIR PRECURSORS GENTIAN AS (NO) 2001-06-14 WO disclosed