SCHEMBL6357616

SCHEMBL6357616

N#Cc1ccccc1N1CCN(CCC(=O)c2ccccc2)CC1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 8/20 0.70
DRD4 P21917 2/20 0.64
DRD2 P14416 1/20 0.64
ALDH1A1 P00352 5/20 0.57
KMT2A Q03164 5/20 0.57
GFER P55789 1/20 0.56
KDM4E B2RXH2 1/20 0.55
LMNA P02545 1/20 0.55
TSHR P16473 1/20 0.55
MPI P34949 1/20 0.55
MAPT P10636 1/20 0.55

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
SCHEMBL6350053 0.83 DRD4 (0.73) HTR1ADRD4DRD2KDM4E
SCHEMBL6350184 0.82 DRD4 (0.72) HTR1ADRD4DRD2ALDH1A1KDM4E
SCHEMBL6350180 0.82 DRD4 (0.72) HTR1ADRD4DRD2ALDH1A1KDM4E
SCHEMBL16026463 0.81 KMT2A (0.83) HTR1AALDH1A1KMT2AGFERMAPT
SCHEMBL17549635 0.81 ALDH1A1 (0.79) HTR1AALDH1A1KMT2AGFERKDM4E
SCHEMBL4687871 0.81 DRD2 (0.58) HTR1ADRD4DRD2
SCHEMBL4935832 0.81 DRD2 (0.58) HTR1ADRD4DRD2
SCHEMBL3196213 0.80 DRD2 (0.57) HTR1ADRD4DRD2
Hydrochloric Acid SCHEMBL7934846 0.80 KMT2A (0.83) HTR1AALDH1A1KMT2AGFERLMNA
SCHEMBL351997 0.79 HTR1A (0.81) HTR1ADRD2ALDH1A1KMT2AGFER

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-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2005-08-11 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-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction CYP19A1, SHBG, CYP17A1 HTR1A 871/4885DRD4 1272/4885DRD2 1704/4885

“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.