SCHEMBL276124

SCHEMBL276124

S=C=Nc1ccc2c(c1)OCCO2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.53
ADRA2B P18089 1/20 0.53
ADRA2C P18825 1/20 0.53
MAPT P10636 10/20 0.47
MAPK1 P28482 4/20 0.47
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.45
ALDH1A1 P00352 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
NR2F2 P24468 1/20 0.42
MIF P14174 2/20 0.41
HTR3E A5X5Y0 1/20 0.41
HTR3B O95264 1/20 0.41
HTR3A P46098 1/20 0.41
HTR3D Q70Z44 1/20 0.41
HTR3C Q8WXA8 1/20 0.41
GAA P10253 4/20 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
SCHEMBL1019410 0.89 HTR3E (0.53) ADRA2AADRA2BADRA2CMAPTMAPK1
SCHEMBL29540837 0.81 ADRA2A (0.53) ADRA2AADRA2BADRA2CMAPTMAPK1
SCHEMBL592019 0.81 ADRA2A (0.53) ADRA2AADRA2BADRA2CMAPTMAPK1
SCHEMBL18876507 0.81 ADRA2A (0.37) ADRA2AADRA2BADRA2CMAPTMAPK1
SCHEMBL27382765 0.80 PNMT (0.47) ADRA2AADRA2BADRA2CMAPTRAB9A
SCHEMBL18879785 0.79 HTT (0.39) ADRA2AADRA2BADRA2CMAPTMAPK1
SCHEMBL21124236 0.77 MAPT (0.49) ADRA2AADRA2BADRA2CMAPTMAPK1
SCHEMBL13840331 0.76 MAPT (0.58) ADRA2AADRA2BADRA2CMAPTMAPK1
SCHEMBL11000954 0.75 PNMT (0.34) ADRA2AADRA2BADRA2CMAPTALDH1A1
SCHEMBL17705746 0.74 ADRA2A (0.59) ADRA2AADRA2BADRA2CMAPTMAPK1

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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024187093-A1 ERK INHIBITORS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-09-12 WO disclosed
EP-3296309-B1 GALACTOPYRANOSYL DERIVATIVES USEFUL AS MEDICAMENTS UNIV GENT (BE) 2019-08-07 EP disclosed
EP-3296309-A1 GALACTOPYRANOSYL DERIVATIVES USEFUL AS MEDICAMENTS Universiteit Gent (BE) 2018-03-21 EP disclosed
EP-2877480-B1 GALACTOPYRANOSYL DERIVATIVES USEFUL AS MEDICAMENTS UNIV GENT (BE) 2017-09-06 EP disclosed
US-9321796-B2 Galactopyranosyl derivatives useful as medicaments UNIVERSITEIT GENT (BE) 2016-04-26 US disclosed
US-20150210728-A1 GALACTOPYRANOSYL DERIVATIVES USEFUL AS MEDICAMENTS AMBICION CO., LTD. (JP) 2015-07-30 US disclosed
EP-2877480-A1 GALACTOPYRANOSYL DERIVATIVES USEFUL AS MEDICAMENTS Universiteit van Gent (BE) 2015-06-03 EP disclosed
WO-2014001204-A1 GALACTOPYRANOSYL DERIVATIVES USEFUL AS MEDICAMENTS UNIVERSITEIT GENT (BE) 2014-01-03 WO disclosed
US-8227498-B2 imidazole derivatives; Alzheimer's Disease, Down syndrome and Huntington's Disease; hypotensive agents; sleeping and eating disorders, anxiolytic agents, antidepressants, antiepileptic agents; drug abuse/withdrawl; 2-cyano(4-ethylphenyl)-3-(3-(5-methyl-1H-imidazol-1-yl)propyl)guanidine PROBIODRUG AG (DE) 2012-07-24 US disclosed
US-8134013-B2 Amide compound and thrombopoietin receptor activator NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-03-13 US disclosed
WO-1993010742-A2 CHEMICAL COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1993-06-10 WO disclosed
EP-0544765-A1 PIPERAZINYL DERIVATIVES. NOVO NORDISK AS (DK) 1993-06-09 EP disclosed
US-5214053-A THIOUREA DERIVATIVES AND ANTIMICROBIAL AGENT AND ANTIULCER AGENT CONTAINING THE SAME TERUMO KABUSHIKI KAISHA (JP) 1993-05-25 US disclosed
EP-0531228-A1 Thiourea derivatives, antimicrobial agent and antiulcer agent containing the same TERUMO KABUSHIKI KAISHA (JP) 1993-03-10 EP disclosed
WO-1992003426-A1 PIPERAZINYL DERIVATIVES NOVO NORDISK A/S (DK) 1992-03-05 WO disclosed
EP-0199400-B1 Substituted N-[(4-piperidinyl)alkyl] bicyclic condensed ozazol- and thiazolamines JANSSEN PHARMACEUTICA N.V. (BE) 1990-09-26 EP disclosed
US-4826848-A Antidepressive substituted N-[(4-piperidinyl)alkyl] bicyclic condensed oxazol- and thiazolamines JANSSEN PHARMACEUTICA N.V. (BE) 1989-05-02 US disclosed
US-4749702-A PARKINSON*S DISEASE, ENTEROKINESIA JANSSEN PHARMACEUTICA N. V. (BE) 1988-06-07 US disclosed
US-4689330-A PARKINSON DISEASE JANSSEN PHARMACEUTICA N.V. (BE) 1987-08-25 US disclosed
EP-0199400-A2 Substituted N-[(4-piperidinyl)alkyl] bicyclic condensed ozazol- and thiazolamines JANSSEN PHARMACEUTICA N.V. (BE) 1986-10-29 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 (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-20150210728-A1 GALACTOPYRANOSYL DERIVATIVES USEFUL AS MEDICAMENTS B3GAT3, GALR3, ST6GAL1 ADRA2A 2262/4885ADRA2B 1138/4885ADRA2C 889/4885

“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.