Dimethylamine

Dimethylamine

SCHEMBL6378373

CCCOc1ccc(C=c2[nH]c(=O)c(=Cc3ccccc3)[nH]c2=O)cc1.CNC

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SERPINE1 P05121 12/20 0.65
▸ HRH3 Q9Y5N1 1/20 0.59
▸ PIM1 P11309 1/20 0.50
▸ PIM2 Q9P1W9 1/20 0.50
▸ MAPT P10636 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ RAF1 P04049 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CDK1 P06493 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CCNB1 P14635 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ FAAH O00519 1/20 0.44
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ RELA Q04206 1/20 0.41

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
SCHEMBL6380172 0.91 SERPINE1 (0.74) SERPINE1HRH3PIM1PIM2MAPT
SCHEMBL6380170 0.91 SERPINE1 (0.74) SERPINE1HRH3PIM1PIM2MAPT
Dimethylamine SCHEMBL6375602 0.89 SERPINE1 (0.65) SERPINE1HRH3PIM1PIM2MAPT
Dimethylamine SCHEMBL6374529 0.88 SERPINE1 (0.63) SERPINE1HRH3PIM1PIM2MAPT
SCHEMBL6375264 0.85 SERPINE1 (0.70) SERPINE1HRH3PIM1PIM2MAPT
SCHEMBL6375268 0.85 SERPINE1 (0.70) SERPINE1HRH3PIM1PIM2MAPT
SCHEMBL9015055 0.83 SERPINE1 (0.67) SERPINE1HRH3RAF1CYP1A2CDK1
SCHEMBL9015052 0.83 SERPINE1 (0.67) SERPINE1HRH3RAF1CYP1A2CDK1
SCHEMBL6375596 0.82 SERPINE1 (0.65) SERPINE1HRH3
SCHEMBL8494433 0.82 SERPINE1 (0.65) SERPINE1HRH3

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
EP-0655060-A1 PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES XENOVA LIMITED (GB) 1995-05-31 — — EP claimed
WO-1994004512-A1 PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES XENOVA LIMITED (GB) 1994-03-03 — — WO claimed
US-20050249681-A1 Use of diketopiperazine derivatives as photostable uv-filters in cosmetic and pharmaceutical preparations BASF AKTIENGESELLSCHAFT (DE) 2005-11-10 — — US disclosed
US-5700804-A INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITORS XENOVA LIMITED (GB) 1997-12-23 — — US disclosed
EP-0655060-A1 PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES XENOVA LIMITED (GB) 1995-05-31 — — EP disclosed
WO-1994004512-A1 PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES XENOVA LIMITED (GB) 1994-03-03 — — 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-20050249681-A1 Use of diketopiperazine derivatives as photostable uv-filters in cosmetic and pharmaceutical preparations DHPS, MC1R, MITF SERPINE1 1257/4885HRH3 1609/4885PIM1 4387/4885

“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.

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