SCHEMBL497817

SCHEMBL497817

CC(NCc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.55
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
MAPT P10636 2/20 0.51
POLB P06746 1/20 0.51
ALDH1A1 P00352 1/20 0.51
TSHR P16473 1/20 0.51
MEP1B Q16820 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NR4A2 P43354 1/20 0.50
CD274 Q9NZQ7 1/20 0.49
LTA4H P09960 1/20 0.49

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
SCHEMBL3556483 1.00 SIGMAR1 (0.55) SIGMAR1MEN1KMT2AMAPTPOLB
SCHEMBL497818 1.00 SIGMAR1 (0.55) SIGMAR1MEN1KMT2AMAPTPOLB
Hydrochloric Acid SCHEMBL7827035 0.98 SIGMAR1 (0.53) SIGMAR1MEN1KMT2AMAPTPOLB
Hydrochloric Acid SCHEMBL29221566 0.98 SIGMAR1 (0.53) SIGMAR1MEN1KMT2AMAPTPOLB
Hydrochloric Acid SCHEMBL1026469 0.98 SIGMAR1 (0.53) SIGMAR1MEN1KMT2AMAPTPOLB
SCHEMBL28499340 0.90 ACP3 (0.51) SIGMAR1MEN1KMT2AMAPTPOLB
SCHEMBL17441374 0.89 ALDH1A1 (0.56) SIGMAR1MEN1KMT2AMAPTALDH1A1
SCHEMBL1997227 0.89 ALDH1A1 (0.56) SIGMAR1MEN1KMT2AMAPTALDH1A1
SCHEMBL24555089 0.88 LTA4H (0.57) MEN1KMT2ATSHRMEP1BLTA4H
Serine SCHEMBL28178645 0.87 ALPI (0.49) SIGMAR1MEN1KMT2APOLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118239879-A Method for preparing 3-substituted oxindole, dihydroisoindigo and tetra-substituted ethane based on primary amine and application of primary amine 泰山学院 2024-06-25 CN claimed
EP-3994238-B1 LUBRICATING COMPOSITIONS CONTAINING BASIC ASHLESS ADDITIVES LUBRIZOL CORP (US) 2024-03-13 EP claimed
CN-111163761-A Targeted drugs related to trimethylamine and/or trimethylamine-N-oxide 普梭梅根公司 2020-05-15 CN claimed
CN-110669742-A Method for improving laccase degrading activity of organophosphorus pesticide 孙芳 2020-01-10 CN claimed
EP-2531487-A1 ARYL BENZYLAMINE COMPOUNDS Novartis AG (CH) 2012-12-12 EP claimed
WO-2011095452-A1 ARYL BENZYLAMINE COMPOUNDS NOVARTIS AG (CH) 2011-08-11 WO claimed
US-20100041612-A1 Fragments of the Glucagon-Like Peptide-1 and Uses Thereof NEW ENGLAND MEDICAL CENTER HOSPITALS, INC. 2010-02-18 US claimed
WO-2007030706-A1 FRAGMENTS OF THE GLUCAGON-LIKE PEPTIDE-I AND USES THEREOF NEW ENGLAND MEDICAL CENTER HOSPITALS, INC. (US) 2007-03-15 WO claimed
WO-2025122024-A1 INJECTABLE COMPOSITIONS FOR THE POSTOPERATIVE TREATMENT OF MALIGNANT BRAIN TUMOURS Общество с ограниченной ответственностью "Нейролайт Технолоджи" 2025-06-12 WO disclosed
CN-118239879-A Method for preparing 3-substituted oxindole, dihydroisoindigo and tetra-substituted ethane based on primary amine and application of primary amine 泰山学院 2024-06-25 CN disclosed
US-11925658-B2 Phosphoramidate derivatives of 5-fluoro-2′—deoxyuridine for use in the treatment of cancer NuCana plc (GB) 2024-03-12 US disclosed
WO-2023146991-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed
US-20230165886-A1 PHOSPHORAMIDATE DERIVATIVES OF 5 - FLUORO - 2' - DEOXYURIDINE FOR USE IN THE TREATMENT OF CANCER NuCana plc (GB) 2023-06-01 US disclosed
CN-115746073-A Diastereoselective synthesis of phosphate derivatives and gemcitabine prodrug NUC-1031 努卡那有限公司 2023-03-07 CN disclosed
US-4837204-A RENIN INHIBITORS; HYPOTENSIVE AGENTS ABBOTT LABORATORIES (US) 1989-06-06 US disclosed
EP-0307837-A2 Renin-inhibiting peptidyl heterocycles ABBOTT LABORATORIES (US) 1989-03-22 EP disclosed
EP-0230266-A2 Functionalized peptidyl aminodiols and -triols ABBOTT LABORATORIES (US) 1987-07-29 EP disclosed
US-4069385-A FROM AN OLEFIN AND AN ORGANIC PEROXIDE WITH COPPER-SCHIFF BASE COMPEX AS CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1978-01-17 US disclosed
US-4032567-A TRIIODOISOPHTHALIC ACID MONOAMINO ACID AMIDES, PROCESS FOR THE PREPARATION THEREOF, AND USE THEREOF AS X-RAY CONTRAST MEDIA SCHERING AKTIENGESELLSCHAFT (DT) 1977-06-28 US disclosed
US-3953501-A X-RAY CONTRAST AGENTS SCHERING AKTIENGESELLSCHAFT (DT) 1976-04-27 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 (3 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-20230165886-A1 PHOSPHORAMIDATE DERIVATIVES OF 5 - FLUORO - 2' - DEOXYURIDINE FOR USE IN THE TREATMENT OF CANCER SLC29A2, SLC29A1, TYMP SIGMAR1 4218/4885MEN1 2045/4885KMT2A 2204/4885
US-11925658-B2 Phosphoramidate derivatives of 5-fluoro-2′—deoxyuridine for use in the treatment of cancer SLC29A2, SLC29A1, TYMP SIGMAR1 4272/4885MEN1 1958/4885KMT2A 2029/4885
US-20100041612-A1 Fragments of the Glucagon-Like Peptide-1 and Uses Thereof GLP1R, IAPP, GIPR SIGMAR1 3628/4885MEN1 641/4885KMT2A 4262/4885

“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.