SCHEMBL4514567

SCHEMBL4514567

CCOC(=O)C1CCCN(CCCCl)C1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.59
ALDH1A1 P00352 9/20 0.59
TDP1 Q9NUW8 2/20 0.57
HTR7 P34969 2/20 0.55
HTR1A P08908 1/20 0.55
DRD2 P14416 1/20 0.55
HTR2A P28223 1/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
ATM Q13315 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
MAPK1 P28482 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
TSHR P16473 1/20 0.52

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
SCHEMBL7926306 0.92 ALDH1A1 (0.60) KDM4EALDH1A1TDP1L3MBTL1ATM
SCHEMBL205046 0.92 ALDH1A1 (0.60) KDM4EALDH1A1TDP1L3MBTL1ATM
SCHEMBL9342470 0.89 KDM4E (0.60) KDM4EALDH1A1TDP1HTR7HTR1A
SCHEMBL4506995 0.87 ALDH1A1 (0.59) KDM4EALDH1A1TDP1HTR7HTR1A
SCHEMBL4515067 0.87 ALDH1A1 (0.59) KDM4EALDH1A1TDP1HTR7HTR1A
SCHEMBL20794235 0.86 BCHE (0.68) KDM4EALDH1A1TDP1HTR7HTR1A
SCHEMBL7923817 0.86 ALDH1A1 (0.58) KDM4EALDH1A1TDP1HTR7HTR1A
SCHEMBL8871715 0.86 ALDH1A1 (0.60) KDM4EALDH1A1TDP1L3MBTL1ATM
SCHEMBL7164025 0.86 ALDH1A1 (0.60) KDM4EALDH1A1TDP1L3MBTL1ATM
SCHEMBL4513801 0.85 ALDH1A1 (0.63) KDM4EALDH1A1TDP1L3MBTL1ATM

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-20090258883-A1 1H-Indole-Pyridinecarboxamide and 1H-Indole-Piperidinecarboxamide Compounds LES LABORATOIRES SERVIER (FR) 2009-10-15 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-20090258883-A1 1H-Indole-Pyridinecarboxamide and 1H-Indole-Piperidinecarboxamide Compounds IDO1, AHR, IDO2 KDM4E 2039/4885ALDH1A1 370/4885TDP1 2926/4885

“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.