SCHEMBL4240723

SCHEMBL4240723

O=C(O)c1ccc(COCCCN2CCCCC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.56
CYP2D6 P10635 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
HRH3 Q9Y5N1 8/20 0.53
TEAD3 Q99594 2/20 0.53
KDM4E B2RXH2 6/20 0.52
MAOB P27338 1/20 0.52
ALDH1A1 P00352 3/20 0.51
SLC6A2 P23975 2/20 0.50
HRH1 P35367 2/20 0.50
NPY1R P25929 1/20 0.50
CHRM2 P08172 1/20 0.50
ADRA2C P18825 1/20 0.50
SLC6A4 P31645 1/20 0.50
SLC6A3 Q01959 1/20 0.50
KCNH2 Q12809 1/20 0.50
CACNA1C Q13936 1/20 0.50
SCN5A Q14524 1/20 0.50

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
SCHEMBL4233136 0.86 TEAD3 (0.51) LTA4HNPC1RAB9AHRH3TEAD3
SCHEMBL2088353 0.81 KDM4E (0.75) SMN1; SMN2NPC1RAB9AHRH3KDM4E
SCHEMBL2741684 0.81 LTA4H (0.59) LTA4HHRH3ALDH1A1HRH1KCNH2
SCHEMBL22386773 0.81 LTA4H (0.59) LTA4HHRH3ALDH1A1HRH1KCNH2
SCHEMBL12128564 0.81 LTA4H (0.56) LTA4HCYP2D6HRH3ALDH1A1SLC6A2
SCHEMBL22440218 0.81 LTA4H (0.77) LTA4HSMN1; SMN2NPC1RAB9AHRH3
SCHEMBL12128487 0.80 HRH3 (0.62) LTA4HCYP2D6HRH3MAOBHRH1
SCHEMBL12128585 0.80 HRH3 (0.62) LTA4HCYP2D6HRH3MAOBHRH1
Hydrochloric Acid SCHEMBL4224584 0.80 KDM4E (0.73) SMN1; SMN2NPC1RAB9AHRH3KDM4E
SCHEMBL2087691 0.80 KDM4E (0.72) LTA4HSMN1; SMN2NPC1RAB9AHRH3

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R LTA4H 1731/4885CYP2D6 1331/4885SMN1; SMN2 1538/4885

“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.