SCHEMBL2958028

SCHEMBL2958028

CC(Cc1ccc(O)cc1)NO

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.63
TAAR1 Q96RJ0 3/20 0.57
SLC6A2 P23975 2/20 0.57
ESR1 P03372 4/20 0.55
ESR2 Q92731 4/20 0.55
ADRB2 P07550 7/20 0.51
CYP3A4 P08684 3/20 0.51
MAPK1 P28482 3/20 0.51
ADRB3 P13945 3/20 0.51
NPSR1 Q6W5P4 2/20 0.51
ADRB1 P08588 2/20 0.51
CYP2D6 P10635 1/20 0.51
TSHR P16473 1/20 0.51
HIF1A Q16665 1/20 0.51
HSD17B10 Q99714 1/20 0.51
ADORA3 P0DMS8 1/20 0.51
PTGS1 P23219 1/20 0.51
HTR2A P28223 1/20 0.51
MC4R P32245 1/20 0.51
ADRA1A P35348 1/20 0.51

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
Hydroxyamphetamine SCHEMBL7041719 0.85 TAAR1 (0.66) SLC6A4TAAR1SLC6A2SLC6A3SIGMAR1
Pholedrine SCHEMBL2739157 0.83 TAAR1 (0.63) SLC6A4TAAR1SLC6A2ESR1ESR2
Pholedrine SCHEMBL119262 0.83 TAAR1 (0.63) SLC6A4TAAR1SLC6A2ESR1ESR2
Pholedrine SCHEMBL15286090 0.83 TAAR1 (0.63) SLC6A4TAAR1SLC6A2ESR1ESR2
SCHEMBL12907812 0.81 TAAR1 (0.55) SLC6A4TAAR1SLC6A2ESR1ESR2
SCHEMBL13996943 0.81 CYP2D6 (0.66) SLC6A4TAAR1SLC6A2ESR1ESR2
SCHEMBL3174249 0.80 SIGMAR1 (0.65) SLC6A4TAAR1CYP3A4CYP2D6TSHR
SCHEMBL125441 0.80 SIGMAR1 (0.65) SLC6A4TAAR1CYP3A4CYP2D6TSHR
SCHEMBL8441968 0.79 SIGMAR1 (0.66) SLC6A4TAAR1SLC6A2ESR1ESR2
SCHEMBL14521880 0.79 SIGMAR1 (0.66) SLC6A4TAAR1SLC6A2ESR1ESR2

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 13 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-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-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-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 SLC6A4 629/4885TAAR1 718/4885SLC6A2 456/4885
US-20070049643-A1 Hydroxylamine derivatives C9, C1S, HTT SLC6A4 708/4885TAAR1 707/4885SLC6A2 561/4885

“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.