SCHEMBL21999366

SCHEMBL21999366

CCCCCCCC(=O)NCCCN1CCOCC1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.60
PAOX Q6QHF9 1/20 0.58
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
GAA P10253 1/20 0.55
FAAH O00519 2/20 0.54
LMNA P02545 2/20 0.54
KDM4E B2RXH2 1/20 0.54
HPGD P15428 1/20 0.53
DUSP3 P51452 1/20 0.53
HSD17B10 Q99714 1/20 0.51
MAPK1 P28482 1/20 0.51
HIF1A Q16665 1/20 0.51

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
SCHEMBL8591441 1.00 ALDH1A1 (0.60) ALDH1A1PAOXMEN1KMT2ANPSR1
SCHEMBL21998731 1.00 ALDH1A1 (0.60) ALDH1A1PAOXMEN1KMT2ANPSR1
SCHEMBL9633172 1.00 ALDH1A1 (0.60) ALDH1A1PAOXMEN1KMT2ANPSR1
SCHEMBL21999365 1.00 ALDH1A1 (0.60) ALDH1A1PAOXMEN1KMT2ANPSR1
SCHEMBL9544143 1.00 ALDH1A1 (0.60) ALDH1A1PAOXMEN1KMT2ANPSR1
Hydrochloric Acid SCHEMBL29729374 0.99 ALDH1A1 (0.59) ALDH1A1PAOXMEN1KMT2ANPSR1
SCHEMBL7158304 0.94 ALDH1A1 (0.63) ALDH1A1PAOXMEN1KMT2ANPSR1
SCHEMBL9633498 0.93 FAAH (0.55) ALDH1A1PAOXMEN1KMT2AFAAH
SCHEMBL26393724 0.93 FAAH (0.55) ALDH1A1PAOXMEN1KMT2AFAAH
Lactic Acid SCHEMBL6314994 0.91 ALDH1A1 (0.53) ALDH1A1PAOXMEN1KMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200148937-A1 INHIBITING HYDROCARBON HYDRATE AGGLOMERATION COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2020-05-14 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 (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-20200148937-A1 INHIBITING HYDROCARBON HYDRATE AGGLOMERATION H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, AHR, SHH ALDH1A1 2259/4885PAOX 3601/4885MEN1 2749/4885

“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.