SCHEMBL1750832

SCHEMBL1750832

O=c1c(Cl)c(O)cnn1-c1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.70
ALDH1A1 P00352 5/20 0.70
SMN1; SMN2 Q16637 4/20 0.70
MAPT P10636 4/20 0.70
HTT P42858 3/20 0.70
NPC1 O15118 3/20 0.70
PAX8 Q06710 2/20 0.70
MITF O75030 1/20 0.70
S1PR4 O95977 1/20 0.70
THRB P10828 1/20 0.70
XBP1 P17861 1/20 0.70
S1PR1 P21453 1/20 0.70
CYP1A2 P05177 2/20 0.60
CYP2C9 P11712 2/20 0.60
GAA P10253 1/20 0.54
NPSR1 Q6W5P4 2/20 0.54
RXFP1 Q9HBX9 2/20 0.54
MEN1 O00255 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52

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
SCHEMBL9664481 0.86 RAB9A (0.54) RAB9AALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL1461789 0.82 RAB9A (1.00) RAB9AALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL10813548 0.79 RAB9A (0.70) RAB9AALDH1A1SMN1; SMN2MAPTHTT
Pyrazon SCHEMBL1858918 0.79 RAB9A (0.70) RAB9AALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL9918817 0.79 ALDH1A1 (0.51) RAB9AALDH1A1SMN1; SMN2MAPTHTT
Pyrazon SCHEMBL53824 0.79 RAB9A (0.70) RAB9AALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL9240283 0.79 RAB9A (0.70) RAB9AALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL13219321 0.76 ALDH1A1 (0.70) RAB9AALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL4191657 0.76 RAB9A (0.76) RAB9AALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL9397355 0.76 RAB9A (0.76) RAB9AALDH1A1SMN1; SMN2MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269715-A1 ABNORMAL CANNABIDIOLS AS AGENTS FOR LOWERING INTRAOCULAR PRESSURE ALLERGAN, INC. 2011-11-03 US claimed
US-7968711-B2 Isoprenyl-3-methylcyclohex-2-enyl)benzene-1,3-diol, 2-(3,5-Difluorophenyl)-5-hydroxypyridazin-3-one, 4-Bromo-2-(2,5-dichlorophenyl)-5-hydroxypyridazin-3-one; glaucoma or ocular hypertension ALLERGAN, INC. (US) 2011-06-28 US claimed
EP-2123264-A1 Heterocyclic derivatives as abnormal cannabidiols agents for lowering intraocular pressure Allergan, Inc. (US) 2009-11-25 EP claimed
EP-0413244-A2 Process for separation and recycling of by-products from the wastewater of the synthesis of 5-amino-4-chloro-2-phenyl-3(2H)-pyridazinone BASF Aktiengesellschaft (DE) 1991-02-20 EP claimed
US-20110269715-A1 ABNORMAL CANNABIDIOLS AS AGENTS FOR LOWERING INTRAOCULAR PRESSURE ALLERGAN, INC. 2011-11-03 US disclosed
US-7968711-B2 Isoprenyl-3-methylcyclohex-2-enyl)benzene-1,3-diol, 2-(3,5-Difluorophenyl)-5-hydroxypyridazin-3-one, 4-Bromo-2-(2,5-dichlorophenyl)-5-hydroxypyridazin-3-one; glaucoma or ocular hypertension ALLERGAN, INC. (US) 2011-06-28 US disclosed
EP-2123264-A1 Heterocyclic derivatives as abnormal cannabidiols agents for lowering intraocular pressure Allergan, Inc. (US) 2009-11-25 EP disclosed
US-20090012088-A1 Compounds for the Treatment of Neurodegeneration and Stroke THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2009-01-08 US disclosed
US-20090012088-A1 Compounds for the Treatment of Neurodegeneration and Stroke THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2009-01-08 US disclosed
EP-2010165-A2 ABNORMAL CANNABIDIOLS AS AGENTS FOR LOWERING INTRAOCULAR PRESSURE Allergan, Inc. (US) 2009-01-07 EP disclosed
WO-2007127711-A2 ABNORMAL CANNABIDIOLS AS AGENTS FOR LOWERING INTRAOCULAR PRESSURE ALLERGAN, INC. (US) 2007-11-08 WO disclosed
US-20070249596-A1 ABNORMAL CANNABIDIOLS AS AGENTS FOR LOWERING INTRAOCULAR PRESSURE ALLERGAN, INC. 2007-10-25 US disclosed
US-20070032496-A1 Compounds for the Treatment of Neurodegeneration and Stroke THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2007-02-08 US disclosed
US-20070032496-A1 Compounds for the Treatment of Neurodegeneration and Stroke THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2007-02-08 US disclosed
WO-2007014226-A2 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATION AND STROKE THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-02-01 WO disclosed
EP-0413244-A2 Process for separation and recycling of by-products from the wastewater of the synthesis of 5-amino-4-chloro-2-phenyl-3(2H)-pyridazinone BASF Aktiengesellschaft (DE) 1991-02-20 EP disclosed
EP-0413244-A2 Process for separation and recycling of by-products from the wastewater of the synthesis of 5-amino-4-chloro-2-phenyl-3(2H)-pyridazinone BASF Aktiengesellschaft (DE) 1991-02-20 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 (4 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-20070249596-A1 ABNORMAL CANNABIDIOLS AS AGENTS FOR LOWERING INTRAOCULAR PRESSURE CNR2, CNR1, PTGIR RAB9A 342/4885ALDH1A1 3297/4885SMN1; SMN2 4837/4885
US-20070032496-A1 Compounds for the Treatment of Neurodegeneration and Stroke PARP1, PARP12, PARP11 RAB9A 2534/4885ALDH1A1 1519/4885SMN1; SMN2 89/4885
US-20090012088-A1 Compounds for the Treatment of Neurodegeneration and Stroke PARP1, PARP12, PARP11 RAB9A 2534/4885ALDH1A1 1519/4885SMN1; SMN2 89/4885
US-20110269715-A1 ABNORMAL CANNABIDIOLS AS AGENTS FOR LOWERING INTRAOCULAR PRESSURE CNR2, CNR1, PTGIR RAB9A 342/4885ALDH1A1 3297/4885SMN1; SMN2 4837/4885

“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.