SCHEMBL527199

SCHEMBL527199

Cc1c2c(nc3ccccc13)CCCC2

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 7/20 0.65
BCHE P06276 6/20 0.65
ALDH1A1 P00352 4/20 0.65
TSHR P16473 2/20 0.65
HSD17B10 Q99714 2/20 0.65
CYP1A2 P05177 2/20 0.65
CYP2D6 P10635 2/20 0.65
KDM4E B2RXH2 2/20 0.65
CACNB4 O00305 1/20 0.65
CACNA1A O00555 1/20 0.65
SLC22A2 O15244 1/20 0.65
SLC22A1 O15245 1/20 0.65
ABCC4 O15439 1/20 0.65
CACNA1G O43497 1/20 0.65
CACNG3 O60359 1/20 0.65
CACNA1F O60840 1/20 0.65
CACNA1H O95180 1/20 0.65
APP P05067 1/20 0.65
FABP1 P07148 1/20 0.65
CHRM2 P08172 1/20 0.65

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
SCHEMBL527589 0.98 BCHE (0.66) ACHEBCHEALDH1A1TSHRHSD17B10
SCHEMBL12442826 0.96 BCHE (0.65) ACHEBCHEALDH1A1TSHRHSD17B10
SCHEMBL11832472 0.81 ALDH1A1 (0.55) ACHEBCHEALDH1A1TSHRHSD17B10
SCHEMBL11836752 0.81 ALDH1A1 (0.51) ACHEBCHEALDH1A1TSHRHSD17B10
SCHEMBL11834580 0.80 ALDH1A1 (0.54) ACHEBCHEALDH1A1TSHRHSD17B10
Hydrochloric Acid SCHEMBL11828754 0.80 ALDH1A1 (0.57) ACHEBCHEALDH1A1TSHRHSD17B10
Hydrochloric Acid SCHEMBL11837304 0.80 ALDH1A1 (0.53) ACHEBCHEALDH1A1TSHRHSD17B10
SCHEMBL11833927 0.80 ALDH1A1 (0.50) ACHEBCHEALDH1A1TSHRHSD17B10
SCHEMBL16745570 0.79 ACHE (0.72) ACHEBCHEAPPGRIN1GRIN2A
Tacrine SCHEMBL7714835 0.79 ACHE (1.00) ACHEBCHEALDH1A1TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230301984-A1 CYCLIC COMPOUNDS FOR USE IN TREATING RETINAL DEGENERATION THE USA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-09-28 US disclosed
WO-2018043761-A1 SPECIFICALLY SUBSTITUTED AZA-DIBENZOFURANS AND AZA-DIBENZOTHIOPHENES FOR ORGANIC ELECTRONIC DEVICES IDEMITSU KOSAN CO.,LTD. (JP) 2018-03-08 WO disclosed
US-9551701-B2 Method for detecting analyte in a bodily fluid, and dressing for implementing such a method Commissariat à l'Energie Atomique et aux Energies Alternatives (FR) 2017-01-24 US disclosed
US-9551701-B2 Method for detecting analyte in a bodily fluid, and dressing for implementing such a method Commissariat à l'Energie Atomique et aux Energies Alternatives (FR) 2017-01-24 US disclosed
US-9551701-B2 Method for detecting analyte in a bodily fluid, and dressing for implementing such a method Commissariat à l'Energie Atomique et aux Energies Alternatives (FR) 2017-01-24 US disclosed
US-9328093-B2 Selective inhibitors of ubiquitin specific protease 7, the pharmaceutical compositions thereof and their therapeutic applications HYBRIGENICS SA (FR) 2016-05-03 US disclosed
US-20150072973-A1 NOVEL SELECTIVE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 7, THE PHARMACEUTICAL COMPOSITIONS THEREOF AND THEIR THERAPEUTIC APPLICATIONS HYBRIGENICS SA (FR) 2015-03-12 US disclosed
US-20140162980-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES SYNGENTA CROP PROTECTION LLC (US) 2014-06-12 US disclosed
US-20140162980-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES SYNGENTA CROP PROTECTION LLC (US) 2014-06-12 US disclosed
US-20140162980-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES SYNGENTA CROP PROTECTION LLC (US) 2014-06-12 US disclosed
US-7491741-B2 Diaminopropionic acid derivatives HOFFMANN-LA ROCHE INC. (US) 2009-02-17 US disclosed
US-7402600-B2 Nitroderivatives of cardiovascular agents NICOX S.A. (FR) 2008-07-22 US disclosed
US-7388017-B2 Inhibitors of serine proteases, particularly hepatitis C virus NS3 protease VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-06-17 US disclosed
US-20070155671-A1 Diaminopropionic acid derivatives FOTOUHI NADER 2007-07-05 US disclosed
US-20070155671-A1 Diaminopropionic acid derivatives FOTOUHI NADER 2007-07-05 US disclosed
US-7217728-B2 Diaminopropionic acid derivatives HOFFMANN-LA ROCHE INC. (US) 2007-05-15 US disclosed
US-7217728-B2 Diaminopropionic acid derivatives HOFFMANN-LA ROCHE INC. (US) 2007-05-15 US disclosed
EP-0276842-B1 SILVER HALIDE PHOTOGRAPHIC MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1992-07-29 EP disclosed
US-4859579-A Silver halide photographic material FUJI PHOTO FILM CO., LTD. (JP) 1989-08-22 US disclosed
EP-0276842-A2 Silver halide photographic material FUJI PHOTO FILM CO., LTD. (JP) 1988-08-03 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-20070155671-A1 Diaminopropionic acid derivatives AIFM1, HIF1A, AIFM2 ACHE 3960/4885BCHE 4042/4885ALDH1A1 16/4885
US-20230301984-A1 CYCLIC COMPOUNDS FOR USE IN TREATING RETINAL DEGENERATION ALDH1A2, PDE6D, PDE6C ACHE 1674/4885BCHE 1914/4885ALDH1A1 145/4885
US-20140162980-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES PRDX4, PRDX6, DDT ACHE 736/4885BCHE 1883/4885ALDH1A1 1961/4885
US-20150072973-A1 NOVEL SELECTIVE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 7, THE PHARMACEUTICAL COMPOSITIONS THEREOF AND THEIR THERAPEUTIC APPLICATIONS USP7, SENP7, PSMA7 ACHE 2065/4885BCHE 970/4885ALDH1A1 3216/4885

“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.