SCHEMBL18395850

SCHEMBL18395850

Cn1cc(C[C@@H](NC(=O)C(C[C@H](C(=O)O)C(C)(C)C)NC(=O)OC(C)(C)C)C(=O)OCc2ccccc2)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.46
▸ TACR1 P25103 2/20 0.46
▸ HDAC3 O15379 1/20 0.44
▸ HDAC4 P56524 1/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ HDAC7 Q8WUI4 1/20 0.44
▸ HDAC2 Q92769 1/20 0.44
▸ HDAC10 Q969S8 1/20 0.44
▸ HDAC11 Q96DB2 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.44
▸ HDAC9 Q9UKV0 1/20 0.44
▸ HDAC5 Q9UQL6 1/20 0.44
▸ PPARA Q07869 1/20 0.41
▸ CCKBR P32239 3/20 0.41
▸ REN P00797 1/20 0.41
▸ MMP9 P14780 1/20 0.41
▸ MMP8 P22894 1/20 0.41
▸ ACE P12821 2/20 0.41
▸ IL1RN P18510 1/20 0.40

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
SCHEMBL4935964 0.90 TACR1 (0.54) IDO1TACR1HDAC3HDAC4HDAC1
SCHEMBL4935955 0.90 TACR1 (0.54) IDO1TACR1HDAC3HDAC4HDAC1
SCHEMBL18395955 0.87 TACR1 (0.47) IDO1TACR1HDAC3HDAC4HDAC1
SCHEMBL18395958 0.87 TACR1 (0.47) IDO1TACR1HDAC3HDAC4HDAC1
SCHEMBL28888815 0.86 TACR1 (0.46) IDO1TACR1HDAC3HDAC4HDAC1
SCHEMBL18395848 0.86 TACR1 (0.46) IDO1TACR1HDAC3HDAC4HDAC1
SCHEMBL18395849 0.86 TACR1 (0.46) IDO1TACR1HDAC3HDAC4HDAC1
SCHEMBL30024543 0.86 TACR1 (0.46) IDO1TACR1HDAC3HDAC4HDAC1
SCHEMBL18407273 0.85 IDO1 (0.47) IDO1TACR1HDAC3HDAC4HDAC1
SCHEMBL18413846 0.84 IDO1 (0.53) IDO1TACR1KLK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11485705-B2 Salts and prodrugs of 1-methyl-d-tryptophan LUMOS PHARMA, INC. (US) 2022-11-01 — — US disclosed
EP-3613420-B1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN LUMOS PHARMA INC (US) 2022-05-25 — — EP disclosed
EP-3954369-A1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN Lumos Pharma, Inc. (US) 2022-02-16 — — EP disclosed
EP-3324958-B1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN LUMOS PHARMA INC (US) 2021-07-28 — — EP disclosed
US-20200283385-A1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN LUMOS PHARMA, INC. 2020-09-10 — — US disclosed
EP-3613420-A1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN Newlink Genetics Corporation (US) 2020-02-26 — — EP disclosed
US-20190248739-A1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN LUMOS PHARMA, INC. 2019-08-15 — — US disclosed
US-10207990-B2 Salts and prodrugs of 1-methyl-D-tryptophan NEWLINK GENETICS CORPORATION (US) 2019-02-19 — — US disclosed
EP-3324958-A1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN Newlink Genetics Corporation (US) 2018-05-30 — — EP disclosed
US-20180134658-A1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN LUMOS PHARMA, INC. 2018-05-17 — — US disclosed
US-9732035-B2 Salts and prodrugs of 1-methyl-D-tryptophan NEWLINK GENETICS CORPORATION (US) 2017-08-15 — — US disclosed
WO-2017019175-A1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN NEWLINK GENETICS CORPORATION (US) 2017-02-02 — — WO disclosed
US-20170022157-A1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN LUMOS PHARMA, INC. 2017-01-26 — — 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 (6 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-20190248739-A1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN IDO1, IDO2, INMT IDO1 1/4885TACR1 2296/4885HDAC3 771/4885
US-10207990-B2 Salts and prodrugs of 1-methyl-D-tryptophan IDO1, IDO2, INMT IDO1 1/4885TACR1 2296/4885HDAC3 771/4885
US-20200283385-A1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN IDO1, IDO2, INMT IDO1 1/4885TACR1 2296/4885HDAC3 771/4885
US-11485705-B2 Salts and prodrugs of 1-methyl-d-tryptophan IDO1, IDO2, INMT IDO1 1/4885TACR1 2296/4885HDAC3 771/4885
US-20170022157-A1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN IDO1, IDO2, INMT IDO1 1/4885TACR1 2296/4885HDAC3 771/4885
US-20180134658-A1 SALTS AND PRODRUGS OF 1-METHYL-D-TRYPTOPHAN IDO1, IDO2, INMT IDO1 1/4885TACR1 2296/4885HDAC3 771/4885

“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.

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