Dimethylamine

Dimethylamine

SCHEMBL496544

CNC.Nc1cccc(Nc2nn3c(-c4ccccc4)nnc3c3ccccc23)c1

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.52
TSHR P16473 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MAPT P10636 3/20 0.48
POLB P06746 2/20 0.48
GABRA1 P14867 1/20 0.48
GABRG2 P18507 1/20 0.48
GABRB3 P28472 1/20 0.48
GABRA5 P31644 1/20 0.48
GABRA3 P34903 1/20 0.48
GABRA2 P47869 1/20 0.48
RXFP1 Q9HBX9 2/20 0.47
KDM4E B2RXH2 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
THRB P10828 1/20 0.47
TP53 P04637 1/20 0.44

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
SCHEMBL496490 0.88 RXFP1 (0.43) NPC1TSHRRAB9ASMN1; SMN2MAPT
Dimethylamine SCHEMBL496715 0.87 NPC1 (0.56) NPC1TSHRRAB9ASMN1; SMN2MAPT
SCHEMBL496586 0.87 MAPT (0.60) NPC1RAB9ASMN1; SMN2MAPTGABRA1
SCHEMBL496632 0.84 MAPT (0.50) NPC1TSHRRAB9ASMN1; SMN2MAPT
SCHEMBL496562 0.81 PDE2A (0.48) SMN1; SMN2MAPTPOLBRXFP1KDM4E
SCHEMBL496563 0.81 PDE2A (0.46) SMN1; SMN2MAPTPOLBGABRA1GABRG2
SCHEMBL2825175 0.81 PDE2A (0.61) NPC1RAB9ASMN1; SMN2MAPTPOLB
SCHEMBL496542 0.81 PDE2A (0.44) SMN1; SMN2MAPTPOLBGABRA1GABRG2
SCHEMBL496760 0.81 RXFP1 (0.46) TSHRMAPTGABRA1GABRG2GABRB3
SCHEMBL496764 0.78 PDE2A (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836207-B1 TRIAZOLOPHTHALAZINES AS PDE2-INHIBITORS NYCOMED GMBH (DE) 2012-10-10 EP disclosed
US-8106047-B2 (4-Methoxyphenyl)-[3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl]-amine; phosphodiesterase inhibitors; septic shock or vascular edema; neoangiogenesis or inflammatory disease NYCOMED GMBH (DE) 2012-01-31 US disclosed
US-20080312225-A1 Triazolophthalazines NYCOMED GMBH (DE) 2008-12-18 US disclosed
EP-1836207-A2 TRIAZOLOPHTHALAZINES AS PDE2-INHIBITORS Nycomed GmbH (DE) 2007-09-26 EP disclosed
WO-2006072615-A2 TRIAZOLOPHTHALAZINES AS PDE2-INHIBITORS NYCOMED GMBH (DE) 2006-07-13 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 (1 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-20080312225-A1 Triazolophthalazines PDE2A, PDE3A, PDE12 NPC1 3725/4885TSHR 1052/4885RAB9A 2855/4885

“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.