SCHEMBL4233535

SCHEMBL4233535

CC(=O)N(CCN1CCCCC1)c1ccc(C(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.49
KDM4E B2RXH2 1/20 0.43
OPRM1 P35372 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
ALDH1A1 P00352 3/20 0.42
KMT2A Q03164 3/20 0.42
HRH3 Q9Y5N1 4/20 0.41
GFER P55789 1/20 0.41
ACHE P22303 1/20 0.41
EPHX2 P34913 1/20 0.40
PTGIR P43119 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2C P18825 1/20 0.40
DRD3 P35462 1/20 0.40
HTR2B P41595 1/20 0.40

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
SCHEMBL6209135 0.99 PDK1 (0.47) PDK1KDM4EOPRM1SIGMAR1ALDH1A1
Hydrochloric Acid SCHEMBL5071191 0.97 PDK1 (0.47) PDK1KDM4EOPRM1SIGMAR1ALDH1A1
SCHEMBL4229105 0.92 ADRA2A (0.48) PDK1KDM4EALDH1A1KMT2AHRH3
Hydrochloric Acid SCHEMBL7564501 0.83 PDK1 (0.44) PDK1OPRM1SIGMAR1ALDH1A1KMT2A
SCHEMBL5065542 0.81 PDK1 (0.43) PDK1KDM4EKMT2AHRH3ACHE
SCHEMBL4240951 0.78 ALDH1A1 (0.49) PDK1ALDH1A1KMT2AHRH3GFER
SCHEMBL5065538 0.78 PDK1 (0.41) PDK1OPRM1SIGMAR1ALDH1A1KMT2A
SCHEMBL4235368 0.76 ALDH1A1 (0.47) KDM4EALDH1A1KMT2AHRH3GFER
SCHEMBL7231255 0.75 NPC1 (0.54) KDM4EALDH1A1HRH3
SCHEMBL652110 0.74 KMT2A (0.45) PDK1ALDH1A1KMT2A

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 3 patents. 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
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
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 PDK1 1576/4885KDM4E 1604/4885OPRM1 179/4885

“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.