SCHEMBL698882

SCHEMBL698882

O=C(O)CN(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.64
ALDH1A1 P00352 4/20 0.50
POLB P06746 1/20 0.50
HTT P42858 1/20 0.49
LTB4R2 Q9NPC1 1/20 0.48
TSHR P16473 3/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
KMT2A Q03164 1/20 0.47
GLA P06280 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
RORC P51449 1/20 0.45
PTGIR P43119 1/20 0.45
MLYCD O95822 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
SCHEMBL3661402 0.89 ALDH1A1 (0.60) ADRA2CALDH1A1POLBHTTLTB4R2
SCHEMBL9716677 0.89 ADRA2C (0.53) ADRA2CALDH1A1POLBTSHRHPGD
SCHEMBL9716701 0.88 ADRA2C (0.55) ADRA2CALDH1A1POLBHTTTSHR
SCHEMBL6174036 0.88 ADRA2C (0.51) ADRA2CHPGDMEN1NPC1KMT2A
SCHEMBL10349935 0.88 MEN1 (0.56) ADRA2CALDH1A1POLBTSHRMEN1
SCHEMBL10660695 0.88 BACE1 (0.52) ADRA2CALDH1A1HPGDMEN1NPC1
SCHEMBL6569544 0.88 PKM (0.56) ADRA2CALDH1A1TSHRHPGDMEN1
SCHEMBL6202036 0.86 ADRA2C (0.57) ADRA2CALDH1A1POLBHTTLTB4R2
SCHEMBL11503381 0.85 ADRA2C (0.49) ADRA2CALDH1A1POLBHTTTSHR
SCHEMBL11503382 0.85 ADRA2C (0.49) ADRA2CALDH1A1POLBHTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125772-B1 A PROCESS FOR THE PREPARATION OF DULOXETIN AND NEW KEY INTERMEDIATES FOR USE THEREIN RICHTER GEDEON NYRT (HU) 2013-09-11 EP claimed
EP-2125772-A1 A PROCESS FOR THE PREPARATION OF DULOXETIN AND NEW KEY INTERMEDIATES FOR USE THEREIN Richter Gedeon NYRT (HU) 2009-12-02 EP claimed
WO-2008078124-A1 A PROCESS FOR THE PREPARATION OF DULOXETIN AND NEW KEY INTERMEDIATES FOR USE THEREIN RICHTER GEDEON NYRT. (HU) 2008-07-03 WO claimed
EP-1114815-B1 Process to prepare taxol UPJOHN CO (US) 2004-09-29 EP claimed
EP-1457487-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE CIS-PIPERIDINE DERIVATIVES Toray Fine Chemicals Co., Ltd. (JP) 2004-09-15 EP claimed
US-20040171836-A1 Method for producing optical-active cis-piperidine derivatives TORAY FINE CHEMICALS CO., LTD., A CORPORATION OF JAPAN, (JP) 2004-09-02 US claimed
EP-0178911-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1992-01-22 EP claimed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US claimed
EP-0178911-A2 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1986-04-23 EP claimed
JP-2053755-A None JP disclosed
JP-61267518-A None JP disclosed
CN-119504598-A Method for preparing azlactone self-coupling body by converting amino acid by using sulfur hexafluoride 国网安徽省电力有限公司电力科学研究院 2025-02-25 CN disclosed
CN-107750245-B (S) -CSA salts of S-ketamine, (R) -CSA salts of S-ketamine and methods for making S-ketamine 詹森药业有限公司 2021-06-22 CN disclosed
US-20210024461-A1 (S)-CSA Salt Of S-Ketamine, (R)-CSA Salt Of S-Ketamine And Processes For The Preparation Of S-Ketamine JANSSEN PHARMACEUTICA NV (BE) 2021-01-28 US disclosed
US-4745124-A THIO/ESTER PEPTIDES UNIVERSITY OF MIAMI (US) 1988-05-17 US disclosed
JP-S61267518-A PENEM-OR CARBAPENEM-TYPE ANTIBIOTIC AGENT HAVING MITIGATED SIDE EFFECT SANKYO CO LTD 1986-11-27 JP disclosed
EP-0178911-A2 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1986-04-23 EP disclosed
EP-0022206-B1 OPTICALLY PURE HETEROCYCLIC AMINO ACIDS, PROCESS FOR THEIR PREPARATION AND THEIR USE BAYER AG (DE) 1984-02-15 EP disclosed
EP-0036713-B1 ANGIOTENSIN CONVERTING ENZYME INHIBITORS UNIVERSITY OF MIAMI (US) 1984-01-18 EP disclosed
EP-0036713-A2 Angiotensin converting enzyme inhibitors UNIVERSITY OF MIAMI (US) 1981-09-30 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 (2 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-20210024461-A1 (S)-CSA Salt Of S-Ketamine, (R)-CSA Salt Of S-Ketamine And Processes For The Preparation Of S-Ketamine STS, SRR, SRM ADRA2C 118/4885ALDH1A1 2695/4885POLB 4005/4885
US-20040171836-A1 Method for producing optical-active cis-piperidine derivatives TYR, DDC, TARBP1 ADRA2C 3087/4885ALDH1A1 947/4885POLB 1463/4885

“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.