SCHEMBL2957274

SCHEMBL2957274

COc1ccc(CCNO)cc1OC

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.71
▸ POLB P06746 1/20 0.71
▸ MAPT P10636 1/20 0.68
▸ KMT2A Q03164 2/20 0.66
▸ CA2 P00918 3/20 0.62
▸ CA12 O43570 2/20 0.62
▸ CA1 P00915 2/20 0.62
▸ CA9 Q16790 2/20 0.62
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ CA5A P35218 1/20 0.59
▸ CA14 Q9ULX7 1/20 0.59
▸ KDM4E B2RXH2 2/20 0.59
▸ MEN1 O00255 1/20 0.57
▸ ALDH1A1 P00352 2/20 0.56
▸ GLA P06280 1/20 0.56
▸ LMNA P02545 1/20 0.56
▸ TSHR P16473 1/20 0.56

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
SCHEMBL7435099 0.85 ATM (0.76) ATMPOLBMAPTKMT2ACA2
Hydrochloric Acid SCHEMBL11808765 0.83 ATM (0.73) ATMPOLBMAPTKMT2ACA2
SCHEMBL557799 0.83 ATM (1.00) ATMPOLBMAPTKMT2ACA2
SCHEMBL8635081 0.83 ATM (1.00) ATMPOLBMAPTKMT2ACA2
SCHEMBL30230461 0.83 ATM (1.00) ATMPOLBMAPTKMT2ACA2
SCHEMBL16641094 0.82 CYP19A1 (0.77) ATMPOLBMAPTKMT2ACA2
SCHEMBL31157848 0.82 CYP19A1 (0.77) ATMPOLBMAPTKMT2ACA2
Iodide SCHEMBL8828192 0.81 ATM (0.96) ATMPOLBMAPTKMT2ACA2
SCHEMBL6966485 0.81 ATM (0.71) ATMPOLBMAPTKMT2ACA2
SCHEMBL19026923 0.81 ATM (0.71) ATMPOLBMAPTKMT2ACA2

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 15 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-20100197799-A1 HYDROXYLAMINE DERIVATIVES NEWRON PHARMACEUTICALS S.P.A. (IT) 2010-08-05 — — US claimed
US-20070049643-A1 Hydroxylamine derivatives VICURON PHARMACEUTICALS INC. 2007-03-01 — — US claimed
EP-1692096-A1 HYDROXYLAMINE DERIVATIVES Newron Pharmaceuticals S.p.A. (IT) 2006-08-23 — — EP claimed
WO-2005058800-A1 HYDROXYLAMINE DERIVATIVES NEWRON PHARMACEUTICALS S.P.A. (IT) 2005-06-30 — — WO 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-1692096-A1 HYDROXYLAMINE DERIVATIVES Newron Pharmaceuticals S.p.A. (IT) 2006-08-23 — — EP disclosed
WO-2005058800-A1 HYDROXYLAMINE DERIVATIVES NEWRON PHARMACEUTICALS S.P.A. (IT) 2005-06-30 — — WO disclosed
EP-0538384-A4 OXAMIDES SMITHKLINE BEECHAM CORP (US) 1995-04-12 — — EP disclosed
US-5393788-A Phenylalkyl oxamides SMITHKLINE BEECHAM CORPORATION (US) 1995-02-28 — — US disclosed
EP-0538384-A1 OXAMIDES SMITHKLINE BEECHAM CORPORATION (US) 1993-04-28 — — EP disclosed
WO-1992000968-A1 OXAMIDES SMITHKLINE BEECHAM CORPORATION (US) 1992-01-23 — — WO 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 ATM 4280/4885POLB 4202/4885MAPT 149/4885
US-20070049643-A1 Hydroxylamine derivatives C9, C1S, HTT ATM 4229/4885POLB 4177/4885MAPT 183/4885

“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.

Send feedback