SCHEMBL515430

SCHEMBL515430

COc1ccc(CCNCCc2ccccc2)cc1OC

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.74
SIGMAR1 Q99720 2/20 0.72
ADRB2 P07550 2/20 0.66
DRD2 P14416 1/20 0.66
DRD1 P21728 1/20 0.66
DRD4 P21917 1/20 0.66
DRD3 P35462 1/20 0.66
POLB P06746 1/20 0.65
ATM Q13315 1/20 0.65
SMN1; SMN2 Q16637 2/20 0.63
ALDH1A1 P00352 3/20 0.62
ALOX15 P16050 1/20 0.62
BCHE P06276 2/20 0.61
PLAAT3 P53816 1/20 0.61
PLAAT5 Q96KN8 1/20 0.61
PLAAT2 Q9NWW9 1/20 0.61
PLAAT4 Q9UL19 1/20 0.61
HTT P42858 3/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61

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
Bromide SCHEMBL11515734 0.98 SLC2A1 (0.72) SLC2A1SIGMAR1ADRB2DRD2DRD1
SCHEMBL27849455 0.94 SLC2A1 (0.85) SLC2A1SIGMAR1ADRB2DRD2DRD1
Hydrochloric Acid SCHEMBL10452455 0.93 SLC2A1 (0.87) SLC2A1SIGMAR1ADRB2DRD2DRD1
Hydrochloric Acid SCHEMBL7272231 0.93 SLC2A1 (0.87) SLC2A1SIGMAR1ADRB2DRD2DRD1
Hydrochloric Acid SCHEMBL7282863 0.93 SLC2A1 (0.70) SLC2A1SIGMAR1ADRB2DRD2DRD1
SCHEMBL7279400 0.92 ALDH1A1 (0.72) SLC2A1SIGMAR1ADRB2SMN1; SMN2ALDH1A1
SCHEMBL13344551 0.92 SLC2A1 (0.87) SLC2A1SIGMAR1ADRB2DRD2DRD1
SCHEMBL7271665 0.91 SLC2A1 (0.64) SLC2A1SIGMAR1ADRB2DRD2DRD1
SCHEMBL7271671 0.91 SLC2A1 (0.64) SLC2A1SIGMAR1ADRB2DRD2DRD1
SCHEMBL7435099 0.91 ATM (0.76) SLC2A1SIGMAR1ADRB2POLBATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210052519-A1 Small molecule drugs and related methods for treatment of diseases related to tdo-43, alpha-synuclein, huntingtin's protein and tau protein oligomer formation ACELOT,INC (US) 2021-02-25 US disclosed
US-20200223788-A1 SMALL MOLECULE DRUGS AND RELATED METHODS FOR TREATMENT OF DISEASES RELATED TO ABETA42 OLIGOMER FORMATION ACELOT, INC. 2020-07-16 US disclosed
US-10703711-B2 Small molecule drugs and related methods for treatment of diseases related to Aβ42 oligomer formation ACELOT, INC. (US) 2020-07-07 US disclosed
US-20190210959-A1 Small molecule drugs and related methods for treatment of diseases related to abeta42 oligomer formation ACELOT, INC. 2019-07-11 US disclosed
EP-2598110-B1 SKIN CARE COMPOSITIONS COMPRISING SUBSTITUTED MONOAMINES UNILEVER PLC (GB) 2015-09-02 EP disclosed
EP-2598110-A2 SKIN CARE COMPOSITIONS COMPRISING SUBSTITUTED MONOAMINES Unilever PLC (GB) 2013-06-05 EP disclosed
US-8293218-B2 Skin care compositions comprising substituted monoamines CONOPCO, INC. (US) 2012-10-23 US disclosed
US-8293218-B2 Skin care compositions comprising substituted monoamines CONOPCO, INC. (US) 2012-10-23 US disclosed
US-8293218-B2 Skin care compositions comprising substituted monoamines CONOPCO, INC. (US) 2012-10-23 US disclosed
US-20120027699-A1 SKIN CARE COMPOSITIONS COMPRISING SUBSTITUTED MONOAMINES CONOPCO, INC., D/B/A UNILEVER (US) 2012-02-02 US disclosed
US-20120027699-A1 SKIN CARE COMPOSITIONS COMPRISING SUBSTITUTED MONOAMINES CONOPCO, INC., D/B/A UNILEVER (US) 2012-02-02 US disclosed
US-20120027699-A1 SKIN CARE COMPOSITIONS COMPRISING SUBSTITUTED MONOAMINES CONOPCO, INC., D/B/A UNILEVER (US) 2012-02-02 US disclosed
WO-2012013418-A2 SKIN CARE COMPOSITIONS COMPRISING SUBSTITUTED MONOAMINES UNILEVER PLC (GB) 2012-02-02 WO disclosed
US-4187314-A DOPAMINERGIC ACTIVITY SMITHKLINE CORPORATION (US) 1980-02-05 US disclosed
US-4175136-A N-Phenethyl-N-propyl-3,4-dihydroxyphenethylamines and salts thereof ROUSSEL UCLAF (FR) 1979-11-20 US disclosed
US-4111957-A DOPAMINERGIC SMITHKLINE CORPORATION (US) 1978-09-05 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 (5 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-20190210959-A1 Small molecule drugs and related methods for treatment of diseases related to abeta42 oligomer formation APP, PSEN2, PSEN1 SLC2A1 3939/4885SIGMAR1 3566/4885ADRB2 888/4885
US-20120027699-A1 SKIN CARE COMPOSITIONS COMPRISING SUBSTITUTED MONOAMINES TYR, CUTA, MAOA SLC2A1 1813/4885SIGMAR1 1071/4885ADRB2 49/4885
US-10703711-B2 Small molecule drugs and related methods for treatment of diseases related to Aβ42 oligomer formation APP, PSEN2, PSEN1 SLC2A1 4086/4885SIGMAR1 4340/4885ADRB2 650/4885
US-20200223788-A1 SMALL MOLECULE DRUGS AND RELATED METHODS FOR TREATMENT OF DISEASES RELATED TO ABETA42 OLIGOMER FORMATION APP, PSEN2, PSEN1 SLC2A1 3939/4885SIGMAR1 3566/4885ADRB2 888/4885
US-20210052519-A1 Small molecule drugs and related methods for treatment of diseases related to tdo-43, alpha-synuclein, huntingtin's protein and tau protein oligomer formation HTT, TARDBP, SNCA SLC2A1 4202/4885SIGMAR1 3016/4885ADRB2 2673/4885

“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.