SCHEMBL6352992

SCHEMBL6352992

CN/N=C(/CN1CCC(c2ccccn2)CC1)c1ccc(F)cc1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 17/20 0.51
DRD2 P14416 9/20 0.51
DRD3 P35462 3/20 0.47
NAMPT P43490 1/20 0.41
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 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
SCHEMBL6352994 1.00 DRD4 (0.51) DRD4DRD2DRD3NAMPTADRA1D
SCHEMBL6353760 0.81 DRD4 (0.76) DRD4DRD2DRD3
SCHEMBL6353764 0.81 DRD4 (0.76) DRD4DRD2DRD3
SCHEMBL4003996 0.75 DRD4 (0.69) DRD4DRD2DRD3
SCHEMBL6211655 0.72 DRD4 (0.66) DRD4DRD2DRD3
SCHEMBL4004216 0.69 DRD4 (0.63) DRD4DRD2DRD3
SCHEMBL6350322 0.69 DRD4 (0.84) DRD4DRD2
SCHEMBL6350324 0.69 DRD4 (0.84) DRD4DRD2
SCHEMBL10819399 0.69 DRD4 (0.54) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL4003191 0.69 DRD4 (0.70) DRD4DRD2DRD3ADRA1DADRA1A

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 2 patents. 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 claimed
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 DRD4 1272/4885DRD2 1704/4885DRD3 1598/4885

“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.