SCHEMBL18546830

SCHEMBL18546830

Cc1ccc(S(=O)(=O)OC[C@@H](C)N(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGER Q15109 1/20 0.41
STAT3 P40763 1/20 0.40
MAPT P10636 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40
GAA P10253 2/20 0.39
GBA1 P04062 1/20 0.38
ALDH1A1 P00352 3/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
C5AR1 P21730 1/20 0.38
DHODH Q02127 1/20 0.37
CA2 P00918 3/20 0.37
CA9 Q16790 3/20 0.37
CA12 O43570 2/20 0.37
VDR P11473 1/20 0.37
HTT P42858 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL18546850 1.00 AGER (0.41) AGERSTAT3MAPTMCOLN3GAA
SCHEMBL18546831 1.00 AGER (0.41) AGERSTAT3MAPTMCOLN3GAA
SCHEMBL2176311 0.82 GAA (0.45) STAT3GAAGBA1ALDH1A1CYP3A4
SCHEMBL4753667 0.82 GAA (0.45) STAT3GAAGBA1ALDH1A1CYP3A4
SCHEMBL4753668 0.82 GAA (0.45) STAT3GAAGBA1ALDH1A1CYP3A4
SCHEMBL777474 0.82 GAA (0.45) STAT3GAAGBA1ALDH1A1CYP3A4
SCHEMBL4757045 0.82 GAA (0.45) STAT3GAAGBA1ALDH1A1CYP3A4
SCHEMBL3317915 0.79 STAT3 (0.44) STAT3GAAGBA1ALDH1A1CYP3A4
SCHEMBL21114440 0.79 GAA (0.42) STAT3GAAGBA1ALDH1A1CYP3A4
SCHEMBL21114439 0.79 GAA (0.42) STAT3GAAGBA1ALDH1A1CYP3A4

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
US-20190002394-A1 SYNTHESIS OF LEVOMETHADONE HYDROCHLORIDE OR DEXTROMETHADONE HYDROCHLORIDE AND METHODS FOR USE THEREOF CODY LABORATORIES, INC. 2019-01-03 US claimed
US-10040752-B2 Synthesis of levomethadone hydrochloride or dextromethadone hydrochloride and methods for use thereof CODY LABORATORIES, INC. (US) 2018-08-07 US claimed
EP-3341354-A1 SYNTHESIS OF LEVOMETHADONE HYDROCHLORIDE OR DEXTROMETHADONE HYDROCHLORIDE AND METHODS FOR USE THEREOF Cody Laboratories, Inc. (US) 2018-07-04 EP claimed
WO-2017035224-A1 SYNTHESIS OF LEVOMETHADONE HYDROCHLORIDE OR DEXTROMETHADONE HYDROCHLORIDE AND METHODS FOR USE THEREOF CODY LABORATORIES, INC. (US) 2017-03-02 WO claimed
US-20170057909-A1 SYNTHESIS OF LEVOMETHADONE HYDROCHLORIDE OR DEXTROMETHADONE HYDROCHLORIDE AND METHODS FOR USE THEREOF ALTER DOMUS (US) LLC 2017-03-02 US claimed
US-20190002394-A1 SYNTHESIS OF LEVOMETHADONE HYDROCHLORIDE OR DEXTROMETHADONE HYDROCHLORIDE AND METHODS FOR USE THEREOF CODY LABORATORIES, INC. 2019-01-03 US disclosed
US-10040752-B2 Synthesis of levomethadone hydrochloride or dextromethadone hydrochloride and methods for use thereof CODY LABORATORIES, INC. (US) 2018-08-07 US disclosed
EP-3341354-A1 SYNTHESIS OF LEVOMETHADONE HYDROCHLORIDE OR DEXTROMETHADONE HYDROCHLORIDE AND METHODS FOR USE THEREOF Cody Laboratories, Inc. (US) 2018-07-04 EP disclosed
WO-2017035224-A1 SYNTHESIS OF LEVOMETHADONE HYDROCHLORIDE OR DEXTROMETHADONE HYDROCHLORIDE AND METHODS FOR USE THEREOF CODY LABORATORIES, INC. (US) 2017-03-02 WO disclosed
US-20170057909-A1 SYNTHESIS OF LEVOMETHADONE HYDROCHLORIDE OR DEXTROMETHADONE HYDROCHLORIDE AND METHODS FOR USE THEREOF ALTER DOMUS (US) LLC 2017-03-02 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-20170057909-A1 SYNTHESIS OF LEVOMETHADONE HYDROCHLORIDE OR DEXTROMETHADONE HYDROCHLORIDE AND METHODS FOR USE THEREOF CYP2D6, COMT, AADAT AGER 4604/4885STAT3 4726/4885MAPT 1028/4885
US-20190002394-A1 SYNTHESIS OF LEVOMETHADONE HYDROCHLORIDE OR DEXTROMETHADONE HYDROCHLORIDE AND METHODS FOR USE THEREOF CYP2D6, COMT, AADAT AGER 4604/4885STAT3 4726/4885MAPT 1028/4885
US-10040752-B2 Synthesis of levomethadone hydrochloride or dextromethadone hydrochloride and methods for use thereof CYP2D6, COMT, AADAT AGER 4604/4885STAT3 4726/4885MAPT 1028/4885

“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.