SCHEMBL1740555

SCHEMBL1740555

CC(O)N(Cc1ccc2c(c1)OCO2)Cc1ccc2c(c1)OCO2

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.55
SLC6A4 P31645 3/20 0.55
SLC6A2 P23975 2/20 0.55
SLC6A3 Q01959 2/20 0.55
CYP3A4 P08684 4/20 0.54
CYP2D6 P10635 2/20 0.53
NPSR1 Q6W5P4 1/20 0.51
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 1/20 0.48
TSHR P16473 1/20 0.48
INSR P06213 1/20 0.48
IGF1R P08069 1/20 0.48
SRC P12931 1/20 0.48
GAA P10253 2/20 0.47
MAPT P10636 1/20 0.47
ATM Q13315 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL16312135 0.87 TAAR1 (0.58) TAAR1SLC6A4SLC6A2SLC6A3CYP3A4
SCHEMBL29417378 0.79 HPGD (0.51) TAAR1SLC6A4SLC6A2SLC6A3CYP3A4
SCHEMBL4168491 0.78 TAAR1 (0.70) TAAR1SLC6A4SLC6A2SLC6A3CYP3A4
SCHEMBL4168488 0.78 TAAR1 (0.70) TAAR1SLC6A4SLC6A2SLC6A3CYP3A4
SCHEMBL4170645 0.78 TAAR1 (0.70) TAAR1SLC6A4SLC6A2SLC6A3CYP3A4
SCHEMBL30147114 0.78 TAAR1 (0.70) TAAR1SLC6A4SLC6A2SLC6A3CYP3A4
SCHEMBL11693746 0.78 HRH2 (0.55) TAAR1SLC6A4SLC6A2SLC6A3CYP3A4
SCHEMBL16312618 0.78 HRH2 (0.55) TAAR1SLC6A4SLC6A2SLC6A3CYP3A4
SCHEMBL108372 0.77 TAAR1 (0.58) TAAR1SLC6A4SLC6A2SLC6A3CYP3A4
SCHEMBL29664514 0.75 TAAR1 (0.57) TAAR1SLC6A4SLC6A2SLC6A3CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200368169-A1 ABUSE-DETERRENT COMPOSITIONS PATHEON SOFTGELS INC (US) 2020-11-26 US disclosed
US-10772842-B2 Abuse-deterrent opioids PATHEON SOFTGELS INC. (US) 2020-09-15 US disclosed
US-10772841-B2 Opioid abuse-deterrent controlled release formulations PATHEON SOFTGELS INC. (US) 2020-09-15 US disclosed
US-10639301-B2 Use of flecainide as an anti-connexin agent and method for potentiating the effects of a psychotropic drug COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2020-05-05 US disclosed
US-10478429-B2 Abuse deterrent dosage forms Patheon Softgels, Inc. (US) 2019-11-19 US disclosed
US-10335405-B1 Non-burst releasing pharmaceutical composition Patheon Softgels, Inc. (US) 2019-07-02 US disclosed
US-10226432-B2 Enteric soft capsule compositions PATHEON SOFTGELS INC. (US) 2019-03-12 US disclosed
US-10182992-B2 Abuse-deterrent controlled release formulations PATHEON SOFTGELS INC. (US) 2019-01-22 US disclosed
US-20190008844-A1 Use of Flecainide as an Anti-Connexin Agent and Method for Potentiating the Effects of a Psychotropic Drug COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2019-01-10 US disclosed
US-10105321-B2 Pharmaceutical compositions resistant to abuse EGALET LTD. (GB) 2018-10-23 US disclosed
WO-2010149169-A2 CONTROLLED RELEASE FORMULATIONS EGALET A/S (DK) 2010-12-29 WO disclosed
US-20100239667-A1 CONTROLLED RELEASE PHARMACEUTICAL COMPOSITIONS FOR PROLONGED EFFECT EGALET A/S (DK) 2010-09-23 US disclosed
WO-2010088911-A1 PHARMACEUTICAL COMPOSITIONS RESISTANT TO ABUSE EGALET A/S (DK) 2010-08-12 WO disclosed
US-20100203130-A1 PHARMACEUTICAL COMPOSITIONS RESISTANT TO ABUSE EGALET A/S (DK) 2010-08-12 US disclosed
WO-2010089132-A1 IMMEDIATE RELEASE COMPOSITION RESISTANT TO ABUSE BY INTAKE OF ALCOHOL EGALET A/S (DK) 2010-08-12 WO disclosed
US-20100203129-A1 CONTROLLED RELEASE FORMULATIONS WITH CONTINUOUS EFFICACY EGALET A/S (DK) 2010-08-12 US disclosed
US-20100204259-A1 IMMEDIATE RELEASE COMPOSITION RESISTANT TO ABUSE BY INTAKE OF ALCOHOL EGALET A/S (DK) 2010-08-12 US disclosed
WO-2010083843-A1 CONTROLLED RELEASE FORMULATIONS WITH CONTINUOUS EFFICACY EGALET A/S (DK) 2010-07-29 WO disclosed
EP-2155167-A2 CONTROLLED RELEASE PHARMACEUTICAL COMPOSITIONS FOR PROLONGED EFFECT Egalet A/S (DK) 2010-02-24 EP disclosed
WO-2008148798-A2 CONTROLLED RELEASE PHARMACEUTICAL COMPOSITIONS FOR PROLONGED EFFECT EGALET A/S (DK) 2008-12-11 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 (7 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-10639301-B2 Use of flecainide as an anti-connexin agent and method for potentiating the effects of a psychotropic drug GJA1, GJB2, GAP43 TAAR1 1165/4885SLC6A4 637/4885SLC6A2 317/4885
US-20190008844-A1 Use of Flecainide as an Anti-Connexin Agent and Method for Potentiating the Effects of a Psychotropic Drug GJA1, GJB2, GAP43 TAAR1 1165/4885SLC6A4 637/4885SLC6A2 317/4885
US-20100203130-A1 PHARMACEUTICAL COMPOSITIONS RESISTANT TO ABUSE OPRK1, CES2, OPRM1 TAAR1 441/4885SLC6A4 85/4885SLC6A2 43/4885
US-20100204259-A1 IMMEDIATE RELEASE COMPOSITION RESISTANT TO ABUSE BY INTAKE OF ALCOHOL ADH1C, ADH1A, ADH5 TAAR1 33/4885SLC6A4 355/4885SLC6A2 84/4885
US-20100203129-A1 CONTROLLED RELEASE FORMULATIONS WITH CONTINUOUS EFFICACY ABCB11, CRH, LPXN TAAR1 1377/4885SLC6A4 245/4885SLC6A2 57/4885
US-10105321-B2 Pharmaceutical compositions resistant to abuse OPRK1, CES2, OPRM1 TAAR1 441/4885SLC6A4 85/4885SLC6A2 43/4885
US-20100239667-A1 CONTROLLED RELEASE PHARMACEUTICAL COMPOSITIONS FOR PROLONGED EFFECT SI, GIPR, MLN TAAR1 2115/4885SLC6A4 2559/4885SLC6A2 2547/4885

“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.