Dimethylamine

Dimethylamine

SCHEMBL4143569

C=Cn1cnc2c(NCCC)ncnc21.CNC

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.49
CDK1 P06493 3/20 0.48
CCNB2 O95067 2/20 0.48
CCNB1 P14635 2/20 0.48
CCNB3 Q8WWL7 2/20 0.48
TMIGD3 P0DMS9 4/20 0.47
ADORA2A P29274 4/20 0.47
ADORA1 P30542 4/20 0.47
ADORA2B P29275 1/20 0.46
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
NPC1 O15118 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTT P42858 1/20 0.41
YTHDC1 Q96MU7 1/20 0.40
SLC29A1 Q99808 1/20 0.39

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
Dimethylamine SCHEMBL4134839 0.89 SRC (0.51) SRCCDK1CCNB2CCNB1CCNB3
SCHEMBL4134836 0.83 SRC (0.48) SRCCDK1CCNB2CCNB1CCNB3
SCHEMBL4120821 0.81 YTHDC1 (0.60) SRCADORA2AADORA1ADORA2BPDE4A
SCHEMBL4143566 0.81 SRC (0.46) SRCCDK1CCNB2CCNB1CCNB3
SCHEMBL22326727 0.79 ADORA2A (0.69) CDK1CCNB2CCNB1CCNB3TMIGD3
SCHEMBL18520986 0.77 YTHDC1 (0.63) CDK1CCNB2CCNB1CCNB3TMIGD3
SCHEMBL28252137 0.76 CDK1 (0.53) SRCCDK1CCNB2CCNB1CCNB3
SCHEMBL28252181 0.76 CDK1 (0.53) CDK1CCNB2CCNB1CCNB3TMIGD3
SCHEMBL21539428 0.76 CDK1 (0.53) CDK1CCNB2CCNB1CCNB3TMIGD3
SCHEMBL18521194 0.73 CCNB2 (0.82) CDK1CCNB2CCNB1CCNB3TMIGD3

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-8586566-B2 Unsaturated heterocyclic derivatives ARIAD PHARMACEUTICALS, INC. (US) 2013-11-19 US disclosed
US-20120178716-A1 Unsaturated Heterocyclic Derivatives ARIAD PHARMACEUTICALS, INC. (US) 2012-07-12 US disclosed
US-8071609-B2 Unsaturated heterocyclic derivatives ARIAD PHARMACEUTICALS, INC. (US) 2011-12-06 US disclosed
US-20090156596-A1 Unsaturated Heterocyclic Derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090156596-A1 Unsaturated Heterocyclic Derivatives CYP2F1, CYP2J2, ALOX5 SRC 4651/4885CDK1 591/4885CCNB2 265/4885
US-20120178716-A1 Unsaturated Heterocyclic Derivatives CYP2F1, CYP2J2, ALOX5 SRC 4651/4885CDK1 591/4885CCNB2 265/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.