SCHEMBL2955058

SCHEMBL2955058

CONC1CCc2c(O)cccc2C1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.63
DRD3 P35462 9/20 0.63
DRD4 P21917 7/20 0.63
CA1 P00915 3/20 0.62
CA2 P00918 3/20 0.62
ACHE P22303 3/20 0.62
MTNR1A P48039 1/20 0.50
MTNR1B P49286 1/20 0.50
HTR1A P08908 1/20 0.49
DRD1 P21728 1/20 0.49
DRD5 P21918 1/20 0.49
HTR7 P34969 1/20 0.49
ADRB2 P07550 1/20 0.49

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
SCHEMBL2954959 0.85 DRD2 (0.65) DRD2DRD3DRD4CA1CA2
SCHEMBL14360233 0.84 DRD2 (0.67) DRD2DRD3DRD4CA1CA2
SCHEMBL2953314 0.82 DRD2 (0.64) DRD2DRD3DRD4CA1CA2
SCHEMBL2959295 0.81 DRD2 (0.78) DRD2DRD3DRD4CA1CA2
SCHEMBL2956868 0.81 ADRA1D (0.49) DRD2DRD3DRD4CA1CA2
SCHEMBL14360258 0.80 DRD2 (0.79) DRD2DRD3DRD4CA1CA2
SCHEMBL10357546 0.79 CA1 (0.75) DRD2DRD3DRD4CA1CA2
SCHEMBL1682786 0.78 DRD2 (1.00) DRD2DRD3DRD4CA1CA2
SCHEMBL1682783 0.78 DRD2 (1.00) DRD2DRD3DRD4CA1CA2
SCHEMBL17446169 0.78 DRD2 (1.00) DRD2DRD3DRD4CA1CA2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1692096-B1 HYDROXYLAMINE DERIVATIVES NEWRON PHARM SPA (IT) 2013-04-03 EP claimed
US-7763751-B2 Hydroxylamine derivatives NEWRON PHARMACEUTICALS S.P.A. (IT) 2010-07-27 US claimed
US-20070049643-A1 Hydroxylamine derivatives VICURON PHARMACEUTICALS INC. 2007-03-01 US claimed
EP-1541547-A1 Hydroxylamine derivatives Newron Pharmaceuticals S.p.A. (IT) 2005-06-15 EP claimed
EP-1692096-B1 HYDROXYLAMINE DERIVATIVES NEWRON PHARM SPA (IT) 2013-04-03 EP disclosed
US-20100197799-A1 HYDROXYLAMINE DERIVATIVES NEWRON PHARMACEUTICALS S.P.A. (IT) 2010-08-05 US disclosed
US-7763751-B2 Hydroxylamine derivatives NEWRON PHARMACEUTICALS S.P.A. (IT) 2010-07-27 US disclosed
US-20070049643-A1 Hydroxylamine derivatives VICURON PHARMACEUTICALS INC. 2007-03-01 US disclosed
EP-1541547-A1 Hydroxylamine derivatives Newron Pharmaceuticals S.p.A. (IT) 2005-06-15 EP 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 (2 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-20100197799-A1 HYDROXYLAMINE DERIVATIVES C9, C1S, HTT DRD2 392/4885DRD3 245/4885DRD4 167/4885
US-20070049643-A1 Hydroxylamine derivatives C9, C1S, HTT DRD2 332/4885DRD3 161/4885DRD4 128/4885

“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.