SCHEMBL6358859

SCHEMBL6358859

O/N=C(/CCN1CCCC(c2nccs2)C1)c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.46
TMEM97 Q5BJF2 3/20 0.46
DRD4 P21917 11/20 0.43
DRD2 P14416 5/20 0.39
CYP2D6 P10635 1/20 0.35
HRH1 P35367 1/20 0.35
CCR3 P51677 1/20 0.35

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
SCHEMBL6358861 1.00 SIGMAR1 (0.46) SIGMAR1TMEM97DRD4DRD2CYP2D6
SCHEMBL6352482 0.89 DRD4 (0.57) DRD4DRD2
SCHEMBL6352480 0.89 DRD4 (0.57) DRD4DRD2
SCHEMBL6351467 0.87 DRD4 (0.52) DRD4DRD2
SCHEMBL6351463 0.87 DRD4 (0.52) DRD4DRD2
SCHEMBL6346741 0.85 ALDH1A1 (0.46) SIGMAR1TMEM97DRD4DRD2HRH1
SCHEMBL6353704 0.80 DRD4 (0.68) DRD4DRD2
SCHEMBL6353708 0.80 DRD4 (0.68) DRD4DRD2
SCHEMBL6357940 0.80 DRD4 (0.68) DRD4DRD2
SCHEMBL6357751 0.75 DRD4 (0.47) SIGMAR1DRD4DRD2

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 SIGMAR1 1275/4885TMEM97 3004/4885DRD4 1272/4885

“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.