SCHEMBL3937405

SCHEMBL3937405

c1ccc(CNC2CCOC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 4/20 0.54
LTA4H P09960 1/20 0.51
BCHE P06276 2/20 0.50
ACHE P22303 2/20 0.50
BACE1 P56817 2/20 0.50
MEN1 O00255 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50
FYN P06241 1/20 0.46
OPRM1 P35372 1/20 0.45
OPRL1 P41146 1/20 0.45
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44

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
SCHEMBL32675244 1.00 GRIN2B (0.54) GRIN2BLTA4HBCHEACHEBACE1
SCHEMBL30164338 0.90 LTA4H (0.62) GRIN2BLTA4HBCHEACHEBACE1
SCHEMBL18290472 0.90 LTA4H (0.62) GRIN2BLTA4HBCHEACHEBACE1
SCHEMBL18792185 0.90 LTA4H (0.62) GRIN2BLTA4HBCHEACHEBACE1
SCHEMBL375264 0.89 GRIN2B (0.62) GRIN2BBCHEACHEBACE1MEN1
SCHEMBL23553927 0.85 MEN1 (0.52) MEN1KMT2A
SCHEMBL20528646 0.85 GRIN2B (0.56) GRIN2BBCHEACHEBACE1MEN1
SCHEMBL12380 0.83 ACHE (0.48) LTA4HBCHEACHEBACE1MEN1
SCHEMBL375157 0.79 MEN1 (0.75) GRIN2BBCHEACHEBACE1MEN1
SCHEMBL16286711 0.79 EGLN2 (0.44) LTA4HMEN1RAB9AKMT2AOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4499620-B1 METHOD FOR THE PREPARATION OF CIS-4-AMINOTETRAHYDROFURAN-2-CARBOXYLATES BAYER AG (DE) 2026-02-18 EP disclosed
US-20180193315-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC (US) 2018-07-12 US disclosed
US-20180071262-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC. (US) 2018-03-15 US disclosed
CN-105073746-B Substituted imidazopyridines as HDM2 inhibitors 默沙东公司 2017-03-22 CN disclosed
US-20160235716-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC. (US) 2016-08-18 US disclosed
WO-2016044770-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC. (US) 2016-03-24 WO disclosed
CN-105073746-A Substituted imidazopyridines as HDM2 inhibitors MERCK SHARP & DOHME 2015-11-18 CN disclosed
CN-101863908-A Oxacyclo-sulfamide spirocyclic medicament template and synthesis method thereof WUXI APP SHANGHAI CO LTD 2010-10-20 CN disclosed
US-7514573-B2 Processes for the manufacture of chiral and racemic forms of 3-aminotetrahydrofurans, their salts and derivatives SAMI LABS LTD (IN) 2009-04-07 US disclosed
US-20080255377-A1 reduction of diesters of aspartic acid, then cyclization with the aid of sulfonic acids, hydrolysis using a base to give 3-(S)-aminotetrahydrofuran as its hydrochloride or p-toluenesulfonate salt, or as base itself MAJEED MUHAMMED 2008-10-16 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 (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-20080255377-A1 reduction of diesters of aspartic acid, then cyclization with the aid of sulfonic acids, hydrolysis using a base to give 3-(S)-aminotetrahydrofuran as its hydrochloride or p-toluenesulfonate salt, or as base itself AASDHPPT, DNPEP, ASNS GRIN2B 1833/4885LTA4H 574/4885BCHE 555/4885
US-20160235716-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE KAT2B, HDAC1, HDAC9 GRIN2B 928/4885LTA4H 2594/4885BCHE 4197/4885
US-20180193315-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE KAT2B, HDAC1, KAT2A GRIN2B 874/4885LTA4H 2814/4885BCHE 4277/4885
US-20180071262-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE KAT2B, HDAC1, HDAC9 GRIN2B 928/4885LTA4H 2594/4885BCHE 4197/4885

“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.