SCHEMBL3523795

SCHEMBL3523795

C#CCOc1cccc(C=O)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.57
MAOA P21397 10/20 0.57
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
CA12 O43570 2/20 0.51
CA9 Q16790 2/20 0.51
CA2 P00918 1/20 0.51
SRC P12931 1/20 0.47
GSTP1 P09211 1/20 0.44
CA1 P00915 1/20 0.42
CA4 P22748 1/20 0.42

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
SCHEMBL29953529 1.00 MAOB (0.57) MAOBMAOANPC1RAB9ATDP1
SCHEMBL30737401 0.85 MAOB (0.49) MAOBMAOANPC1RAB9ATDP1
SCHEMBL29956503 0.83 MAOA (0.54) MAOBMAOANPC1RAB9ATDP1
SCHEMBL2277043 0.83 MAOA (0.57) MAOBMAOANPC1RAB9ATDP1
SCHEMBL28423025 0.82 GSTP1 (0.44) MAOBMAOACA12CA9CA2
SCHEMBL23315105 0.81 CA12 (0.54) MAOBMAOARAB9ACA12CA9
SCHEMBL13338101 0.81 MAOB (0.59) MAOBMAOACA12CA9CA2
SCHEMBL24215088 0.80 MAOA (0.54) MAOBMAOANPC1RAB9ATDP1
SCHEMBL29954271 0.80 MAOA (0.54) MAOBMAOANPC1RAB9ATDP1
SCHEMBL24215090 0.80 MAOA (0.54) MAOBMAOANPC1RAB9ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4306166-A2 COMPOUNDS, COMPOSITIONS AND METHODS OF USE Aquinnah Pharmaceuticals Inc. (US) 2024-01-17 EP disclosed
US-20230303489-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF USE AQUINNAH PHARMACEUTICALS INC (US) 2023-09-28 US disclosed
EP-3557998-B1 COMPOUNS, COMPOSITIONS AND METHODS OF USE AQUINNAH PHARMACEUTICALS INC (US) 2023-08-16 EP disclosed
US-11542233-B2 Compounds, compositions and methods of use AQUINNAH PHARMACEUTICALS, INC. (US) 2023-01-03 US disclosed
US-20220117231-A1 Combination of Novel Nitrification Inhibitors and Herbicides as Well as Combination of (Thio)Phosphoric Acid Triamides and Herbicides BASF SE (DE) 2022-04-21 US disclosed
WO-2022015624-A1 SUBSTITUTED DIHYDROPYRAZINEDIONES AS MODULATORS OF THE NMDA RECEPTOR SCHRÖDINGER, INC. (US) 2022-01-20 WO disclosed
WO-2022015624-A1 SUBSTITUTED DIHYDROPYRAZINEDIONES AS MODULATORS OF THE NMDA RECEPTOR SCHRÖDINGER, INC. (US) 2022-01-20 WO disclosed
US-20200270211-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF USE AQUINNAH PHARMACEUTICALS INC (US) 2020-08-27 US disclosed
CN-111187279-A Glaucocalyxin A-biotin small molecular probe and preparation method and application thereof 新乡医学院 2020-05-22 CN disclosed
EP-3557998-A1 COMPOUNS, COMPOSITIONS AND METHODS OF USE Aquinnah Pharmaceuticals Inc. (US) 2019-10-30 EP disclosed
US-8680265-B2 Process for the preparation of a boron-substituted porphyrin PSIMEI Pharmaceuticals (GB) 2014-03-25 US disclosed
US-8680265-B2 Process for the preparation of a boron-substituted porphyrin PSIMEI Pharmaceuticals (GB) 2014-03-25 US disclosed
US-7691883-B2 Cinnamoyl compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-06 US disclosed
US-20100016613-A1 PROCESS FOR THE PREPARATION OF A BORON-SUBSTITUTED PORPHYRIN PSIMEI PHARMACEUTICALS PLC (GB) 2010-01-21 US disclosed
US-20100016613-A1 PROCESS FOR THE PREPARATION OF A BORON-SUBSTITUTED PORPHYRIN PSIMEI PHARMACEUTICALS PLC (GB) 2010-01-21 US disclosed
US-20070265228-A1 Cinnamoyl compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-15 US disclosed
EP-1671961-A1 CINNAMOYL COMPOUND AND USE OF THE SAME Sumitomo Chemical Company, Limited (JP) 2006-06-21 EP disclosed
US-6150404-A IN SPECIFIED INSECTS, BY EXPOSING THE INSECTS TO FENFLUTHRIN OR CIS, 1R-METHYLENEDIOXYPHENYL-3-(2,2-DIHALOVINYL)-2,2 -DIMETHYLCYCLOPROPANECARBOXYLATE; WHERE METABOLIC MECHANISM OF RESISTANCE IS RESPONSIBLE IF A LARGE PERCENT OF INSECTS DIE BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2000-11-21 US disclosed
EP-0072926-B1 2-ARYLIMIDAZOPYRIDINES MERCK PATENT GmbH (DE) 1986-09-24 EP disclosed
EP-0072926-A1 2-Arylimidazopyridines MERCK PATENT GmbH (DE) 1983-03-02 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 (6 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-11542233-B2 Compounds, compositions and methods of use FUS, TFEB, CLN6 MAOB 2648/4885MAOA 3243/4885NPC1 287/4885
US-20100016613-A1 PROCESS FOR THE PREPARATION OF A BORON-SUBSTITUTED PORPHYRIN SCO2, PPOX, CNOT9 MAOB 1963/4885MAOA 3944/4885NPC1 19/4885
US-20200270211-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF USE FUS, TFEB, CLN6 MAOB 2648/4885MAOA 3243/4885NPC1 287/4885
US-20230303489-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF USE FUS, TFEB, CLN6 MAOB 2648/4885MAOA 3243/4885NPC1 287/4885
US-20220117231-A1 Combination of Novel Nitrification Inhibitors and Herbicides as Well as Combination of (Thio)Phosphoric Acid Triamides and Herbicides NMT2, NAPRT, NAMPT MAOB 1794/4885MAOA 1540/4885NPC1 3167/4885
US-20070265228-A1 Cinnamoyl compound and use of the same NPC1, CES2, CYP51A1 MAOB 2665/4885MAOA 2568/4885NPC1 1/4885

“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.