SCHEMBL6435144

SCHEMBL6435144

O=C(O)N1CCC(NCCCCO)CC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 3/20 0.40
EPHX1 P07099 1/20 0.38
KDM4E B2RXH2 2/20 0.37
DPP4 P27487 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM3 P20309 1/20 0.36
EPHX2 P34913 1/20 0.35
DRD2 P14416 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CXCR4 P61073 1/20 0.33
DRD3 P35462 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHRM1 P11229 1/20 0.33
SMYD3 Q9H7B4 1/20 0.33

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
SCHEMBL477251 0.95 DRD4 (0.40) DRD4KDM4ECHRM2CHRM5CHRM3
SCHEMBL28813230 0.94 EPHX1 (0.41) DRD4EPHX1KDM4EDPP4ALDH1A1
SCHEMBL2225265 0.87 KDM4E (0.40) DRD4KDM4EDPP4CHRM2CHRM5
SCHEMBL6414021 0.85 EPHX2 (0.50) EPHX1KDM4ECHRM2CHRM5CHRM3
SCHEMBL13207141 0.79 EPHX2 (0.47) EPHX1EPHX2
SCHEMBL6419621 0.79 MCHR1 (0.43) DRD4KDM4EDPP4CHRM2CHRM5
SCHEMBL4065999 0.79 KDM4E (0.39) DRD4EPHX1KDM4EDPP4CHRM2
SCHEMBL16795205 0.78 CYP1A2 (0.45) EPHX1SMN1; SMN2SMYD3
SCHEMBL19825570 0.77 LMNA (0.48) SMN1; SMN2
SCHEMBL17743404 0.77

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-20050014789-A1 Amide derivatives as selective serotonin re-uptake inhibitors PFIZER INC 2005-01-20 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-20050014789-A1 Amide derivatives as selective serotonin re-uptake inhibitors SLC6A4, HTR3C, HTR3A DRD4 43/4885EPHX1 1834/4885KDM4E 3765/4885

“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.