Dimethylamine

Dimethylamine

SCHEMBL5833595

CCOc1ccc(B(O)O)c2c1CCCC2.CNC

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 2/20 0.38
POLB P06746 1/20 0.37
TP53 P04637 2/20 0.36
ADRB2 P07550 4/20 0.36
ADRB1 P08588 3/20 0.36
RXRA P19793 3/20 0.36
RXRB P28702 3/20 0.36
RXRG P48443 3/20 0.36
CYP1A2 P05177 2/20 0.36
ADRA2A P08913 1/20 0.36
ADRB3 P13945 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
TSHR P16473 1/20 0.36
NFKB1 P19838 1/20 0.36
HIF1A Q16665 1/20 0.36
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
PMP22 Q01453 1/20 0.35

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 SCHEMBL5833299 0.78 KDM4E (0.40) ALDH1A1KDM4EPOLBTP53ADRB2
SCHEMBL5833588 0.77 NOS3 (0.50) ALDH1A1KDM4ESMN1; SMN2
SCHEMBL6164935 0.76 ADRA1A (0.46) ALDH1A1KDM4EHPGD
SCHEMBL1356087 0.76 LIPE (0.58) RXRARXRBRXRGMEN1KMT2A
SCHEMBL19249309 0.73 RXRG (0.51) ALDH1A1KDM4EPOLBTP53ADRB2
SCHEMBL6167338 0.72 ALDH1A1 (0.38) ALDH1A1KDM4EPOLBTP53RXRA
SCHEMBL12251522 0.71 RXRG (0.53) ALDH1A1KDM4ETP53ADRB2ADRB1
SCHEMBL19249613 0.70 LMNA (0.42) ALDH1A1KDM4EPOLBRXRARXRB
SCHEMBL12251530 0.68 ADRA2A (0.48) ALDH1A1KDM4EPOLBADRB2ADRB1
SCHEMBL5833582 0.68 ADRB1 (0.30) KDM4ETP53ADRB2ADRB1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7012078-B2 2-aminopyridines containing fused ring substituents PFIZER INC. (US) 2006-03-14 US disclosed
EP-1007520-B1 2-AMINOPYRIDINES CONTAINING FUSED RING SUBSTITUENTS AS NOS INHIBITORS PFIZER PROD INC (US) 2003-08-27 EP disclosed
US-20030149017-A1 2-Aminopyridines containing fused ring substituents PFIZER INC. 2003-08-07 US disclosed
US-20010049379-A1 2-aminopyridines containing fused ring substituents LOWE JOHN ADAMS (US) 2001-12-06 US disclosed
EP-1007520-A1 2-AMINOPYRIDINES CONTAINING FUSED RING SUBSTITUENTS AS NOS INHIBITORS Pfizer Products Inc. (US) 2000-06-14 EP disclosed
WO-1999010339-A1 2-AMINOPYRIDINES CONTAINING FUSED RING SUBSTITUENTS AS NOS INHIBITORS PFIZER PRODUCTS INC. (US) 1999-03-04 WO 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-20030149017-A1 2-Aminopyridines containing fused ring substituents NOS2, NOS1, NOS3 ALDH1A1 325/4885KDM4E 1934/4885POLB 2828/4885
US-20010049379-A1 2-aminopyridines containing fused ring substituents NOS2, NOS1, NOS3 ALDH1A1 325/4885KDM4E 1934/4885POLB 2828/4885

“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.