SCHEMBL5046679

SCHEMBL5046679

COC(=O)Cc1cccc(CN)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.63
LOXL2 Q9Y4K0 2/20 0.60
ALDH1A1 P00352 4/20 0.54
GAA P10253 1/20 0.54
GFER P55789 1/20 0.54
CFD P00746 2/20 0.52
HSP90AB1 P08238 1/20 0.50
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
TSHR P16473 2/20 0.47
HPGD P15428 2/20 0.47
MAPT P10636 1/20 0.47
GLS O94925 2/20 0.46
ENPP2 Q13822 1/20 0.46
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
NOS3 P29474 2/20 0.45
NOS1 P29475 2/20 0.45
NOS2 P35228 2/20 0.45

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
Hydrochloric Acid SCHEMBL5046678 0.98 SLC7A5 (0.61) SLC7A5LOXL2ALDH1A1GAAGFER
Hydrochloric Acid SCHEMBL15709809 0.98 SLC7A5 (0.61) SLC7A5LOXL2ALDH1A1GAAGFER
SCHEMBL12400239 0.91 SLC7A5 (0.68) SLC7A5LOXL2ALDH1A1GAAGFER
SCHEMBL30559747 0.86 SLC7A5 (0.60) SLC7A5LOXL2ALDH1A1GAAGFER
SCHEMBL6581681 0.86 SLC7A5 (0.60) SLC7A5LOXL2ALDH1A1GAAGFER
SCHEMBL1987047 0.86 SLC7A5 (0.63) SLC7A5LOXL2ALDH1A1GAAGFER
SCHEMBL4394735 0.85 SLC7A5 (0.62) SLC7A5ALDH1A1GAAGFERHSP90AB1
SCHEMBL4066292 0.85 CYP4F2 (0.63) SLC7A5LOXL2ALDH1A1GAAGFER
Hydrochloric Acid SCHEMBL29112501 0.85 SLC7A5 (0.58) SLC7A5LOXL2ALDH1A1GAAGFER
SCHEMBL7882515 0.84 LOXL2 (0.51) SLC7A5LOXL2ALDH1A1GAAGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873291-B2 Quinoline cGAS antagonist compounds IMMUNESENSOR THERAPEUTICS, INC. (US) 2024-01-16 US disclosed
US-11873291-B2 Quinoline cGAS antagonist compounds IMMUNESENSOR THERAPEUTICS, INC. (US) 2024-01-16 US disclosed
WO-2023227666-A1 PYRIMIDINONE COMPOUNDS FOR TREATING ACUTE INFLAMMATION TES PHARMA S.R.L. (IT) 2023-11-30 WO disclosed
US-20230102879-A1 TRNA SYNTHETASE INHIBITORS PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2023-03-30 US disclosed
US-11261201-B2 TRNA synthetase inhibitors PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2022-03-01 US disclosed
US-11254644-B2 Inhibitors of alpha-amino-beta-carboxymuconic acid semialdehyde decarboxylase TES PHARMA S.R.L. (IT) 2022-02-22 US disclosed
EP-3186242-B1 INHIBITORS OF ALPHA-AMINO-BETA-CARBOXYMUCONIC ACID SEMIALDEHYDE DECARBOXYLASE TES PHARMA S R L (IT) 2021-10-06 EP disclosed
US-20210053997-A1 TRNA SYNTHETASE INHIBITORS PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2021-02-25 US disclosed
US-20200207721-A1 INHIBITORS OF ALPHA-AMINO-BETA-CARBOXYMUCONIC ACID SEMIALDEHYDE DECARBOXYLASE TES PHARMA S.R.L. (IT) 2020-07-02 US disclosed
EP-3456719-A1 COMPOUNDS AND THEIR METHODS OF USE Agios Pharmaceuticals, Inc. (US) 2019-03-20 EP disclosed
US-20050203086-A1 Methods of treatment using an EP2 selective receptor agonist PFIZER INC. 2005-09-15 US disclosed
WO-2004078169-A1 USE OF EP2 SELECTIVE RECEPTOR AGONISTS IN MEDICAL TREATMENT PFIZER PRODUCTS INC. (US) 2004-09-16 WO disclosed
US-20030078261-A1 Prostaglandin agonists CAMERON KIMBERLY O (US) 2003-04-24 US disclosed
US-6498172-B1 (3-(((4-TERT-BUTYL-BENZYL)-(PYRIDINE-3-SULFONYL)-AMINO)-METHYL) -PHENOXY)-ACETIC ACID OR SALT; TREATING SUCH AS OSTEOPOROSIS PFIZER INC. 2002-12-24 US disclosed
US-20020165255-A1 Osteoporosis compounds CAMERON KIMBERLY O (US) 2002-11-07 US disclosed
US-6376502-B1 PROSTAGLANDIN AGONISTS ARE USEFUL FOR THE TREATMENT OF BONE DISORDERS INCLUDING OSTEOPOROSIS. PFIZER INC. 2002-04-23 US disclosed
US-6124314-A A PROSTAGLANDIN AGONISTS FOR TREATING VERTEBRATE BONE DISORDERS PFIZER INC. (US) 2000-09-26 US disclosed
EP-1021410-A1 PROSTAGLANDIN AGONISTS AND THEIR USE TO TREAT BONE DISORDERS PFIZER INC. (US) 2000-07-26 EP disclosed
EP-0911321-A2 Compounds for the treatment of osteoporosis PFIZER INC. (US) 1999-04-28 EP disclosed
WO-1999019300-A1 PROSTAGLANDIN AGONISTS AND THEIR USE TO TREAT BONE DISORDERS PFIZER INC. (US) 1999-04-22 WO 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 (9 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-20210053997-A1 TRNA SYNTHETASE INHIBITORS TRMT1, AARS1, GARS1 SLC7A5 252/4885LOXL2 4413/4885ALDH1A1 2254/4885
US-20200207721-A1 INHIBITORS OF ALPHA-AMINO-BETA-CARBOXYMUCONIC ACID SEMIALDEHYDE DECARBOXYLASE ACMSD, GLS, ALDH7A1 SLC7A5 644/4885LOXL2 1982/4885ALDH1A1 171/4885
US-11873291-B2 Quinoline cGAS antagonist compounds CGAS, GLS2, GLS SLC7A5 1341/4885LOXL2 3342/4885ALDH1A1 4236/4885
US-20230102879-A1 TRNA SYNTHETASE INHIBITORS TRMT1, AARS1, GARS1 SLC7A5 252/4885LOXL2 4413/4885ALDH1A1 2254/4885
US-20020165255-A1 Osteoporosis compounds PTGER1, PTGIR, PTGER4 SLC7A5 3090/4885LOXL2 405/4885ALDH1A1 2288/4885
US-20050203086-A1 Methods of treatment using an EP2 selective receptor agonist PTGER2, PTGES2, PTGFR SLC7A5 4539/4885LOXL2 125/4885ALDH1A1 3293/4885
US-11254644-B2 Inhibitors of alpha-amino-beta-carboxymuconic acid semialdehyde decarboxylase ACMSD, GLS, ALDH7A1 SLC7A5 644/4885LOXL2 1982/4885ALDH1A1 171/4885
US-20030078261-A1 Prostaglandin agonists PTGER1, PTGER4, PTGIR SLC7A5 3466/4885LOXL2 356/4885ALDH1A1 1987/4885
US-11261201-B2 TRNA synthetase inhibitors TRMT1, AARS1, GARS1 SLC7A5 252/4885LOXL2 4413/4885ALDH1A1 2254/4885

“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.