SCHEMBL16135397

SCHEMBL16135397

OC(CC1c2ccccc2-n2cncc21)C1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 19/20 0.60
TDO2 P48775 5/20 0.57
CYP3A4 P08684 3/20 0.51
CYP2D6 P10635 3/20 0.51
CYP2B6 P20813 3/20 0.51
CYP1A2 P05177 1/20 0.43

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
SCHEMBL17665332 0.99 IDO1 (0.61) IDO1TDO2CYP3A4CYP2D6CYP2B6
SCHEMBL16135356 0.99 IDO1 (0.61) IDO1TDO2CYP3A4CYP2D6CYP2B6
SCHEMBL17665331 0.99 IDO1 (0.61) IDO1TDO2CYP3A4CYP2D6CYP2B6
SCHEMBL17665329 0.99 IDO1 (0.61) IDO1TDO2CYP3A4CYP2D6CYP2B6
SCHEMBL17665330 0.99 IDO1 (0.61) IDO1TDO2CYP3A4CYP2D6CYP2B6
SCHEMBL16135347 0.91 TDO2 (0.55) IDO1TDO2CYP3A4CYP2D6CYP2B6
SCHEMBL16135374 0.89 TDO2 (0.53) IDO1TDO2CYP3A4CYP2D6CYP2B6
SCHEMBL16135337 0.87 TDO2 (0.51) IDO1TDO2CYP3A4CYP2D6CYP2B6
SCHEMBL17665472 0.86 IDO1 (0.47) IDO1TDO2CYP3A4CYP2D6CYP2B6
SCHEMBL16135345 0.85 TDO2 (0.52) IDO1TDO2CYP3A4CYP2D6CYP2B6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3366678-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF IMMUNOSUPPRESSION MEDIATED BY TRYPTOPHAN METABOLIZATION Newlink Genetics Corporation (US) 2018-08-29 EP claimed
US-9981973-B2 Tricyclic compounds as inhibitors of immunosuppression mediated by tryptophan metabolization NEWLINK GENETICS CORPORATION (US) 2018-05-29 US claimed
EP-2976332-B1 TRICYCLIC COMPOUNDS AS INHIBITORS OF IMMUNOSUPPRESSION MEDIATED BY TRYPTOPHAN METABOLIZATION. NEWLINK GENETICS CORP (US) 2018-01-31 EP claimed
US-20170260188-A1 Tricyclic Compounds as Inhibitors of Immunosuppression Mediated By Tryptophan Metabolization NEWLINK GENETICS CORPORATION 2017-09-14 US claimed
US-9617272-B2 Tricyclic compounds as inhibitors of immunosuppression mediated by tryptophan metabolization NEWLINK GENETICS CORPORATION (US) 2017-04-11 US claimed
EP-3366678-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF IMMUNOSUPPRESSION MEDIATED BY TRYPTOPHAN METABOLIZATION Newlink Genetics Corporation (US) 2018-08-29 EP disclosed
US-9981973-B2 Tricyclic compounds as inhibitors of immunosuppression mediated by tryptophan metabolization NEWLINK GENETICS CORPORATION (US) 2018-05-29 US disclosed
US-9981973-B2 Tricyclic compounds as inhibitors of immunosuppression mediated by tryptophan metabolization NEWLINK GENETICS CORPORATION (US) 2018-05-29 US disclosed
US-9981973-B2 Tricyclic compounds as inhibitors of immunosuppression mediated by tryptophan metabolization NEWLINK GENETICS CORPORATION (US) 2018-05-29 US disclosed
EP-2976332-B1 TRICYCLIC COMPOUNDS AS INHIBITORS OF IMMUNOSUPPRESSION MEDIATED BY TRYPTOPHAN METABOLIZATION. NEWLINK GENETICS CORP (US) 2018-01-31 EP disclosed
EP-2976332-B1 TRICYCLIC COMPOUNDS AS INHIBITORS OF IMMUNOSUPPRESSION MEDIATED BY TRYPTOPHAN METABOLIZATION. NEWLINK GENETICS CORP (US) 2018-01-31 EP disclosed
US-20170260188-A1 Tricyclic Compounds as Inhibitors of Immunosuppression Mediated By Tryptophan Metabolization NEWLINK GENETICS CORPORATION 2017-09-14 US disclosed
US-20170260188-A1 Tricyclic Compounds as Inhibitors of Immunosuppression Mediated By Tryptophan Metabolization NEWLINK GENETICS CORPORATION 2017-09-14 US disclosed
US-9617272-B2 Tricyclic compounds as inhibitors of immunosuppression mediated by tryptophan metabolization NEWLINK GENETICS CORPORATION (US) 2017-04-11 US disclosed
US-9617272-B2 Tricyclic compounds as inhibitors of immunosuppression mediated by tryptophan metabolization NEWLINK GENETICS CORPORATION (US) 2017-04-11 US disclosed
US-9617272-B2 Tricyclic compounds as inhibitors of immunosuppression mediated by tryptophan metabolization NEWLINK GENETICS CORPORATION (US) 2017-04-11 US disclosed
US-20160060266-A1 Tricyclic Compounds as Inhibitors of Immunosuppression Mediated By Tryptophan Metabolization NEWLINK GENETICS CORPORATION 2016-03-03 US disclosed
US-20160060266-A1 Tricyclic Compounds as Inhibitors of Immunosuppression Mediated By Tryptophan Metabolization NEWLINK GENETICS CORPORATION 2016-03-03 US disclosed
US-20160060266-A1 Tricyclic Compounds as Inhibitors of Immunosuppression Mediated By Tryptophan Metabolization NEWLINK GENETICS CORPORATION 2016-03-03 US disclosed
WO-2014159248-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF IMMUNOSUPPRESSION MEDIATED BY TRYPTOPHAN METABOLIZATION NEWLINK GENETICS CORPORATION (US) 2014-10-02 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 (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-20170260188-A1 Tricyclic Compounds as Inhibitors of Immunosuppression Mediated By Tryptophan Metabolization IDO1, IDO2, TDO2 IDO1 1/4885TDO2 3/4885CYP3A4 142/4885
US-20160060266-A1 Tricyclic Compounds as Inhibitors of Immunosuppression Mediated By Tryptophan Metabolization IDO1, IDO2, TDO2 IDO1 1/4885TDO2 3/4885CYP3A4 149/4885

“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.