SCHEMBL16343354

SCHEMBL16343354

CC(C)(C)OC(=O)N(Cc1cccc(C2CCCC2)c1)C(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CETP P11597 2/20 0.42
▸ KMO O15229 1/20 0.42
▸ NAAA Q02083 1/20 0.42
▸ HDAC4 P56524 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ GRM2 Q14416 1/20 0.37
▸ HTR2C P28335 2/20 0.37
▸ SLC6A4 P31645 2/20 0.37
▸ DRD2 P14416 2/20 0.37
▸ DRD3 P35462 2/20 0.37
▸ NR1H4 Q96RI1 1/20 0.37
▸ STAT3 P40763 2/20 0.37
▸ STAT5B P51692 1/20 0.37
▸ HTR1A P08908 1/20 0.36
▸ OPRM1 P35372 4/20 0.36
▸ OPRD1 P41143 4/20 0.36
▸ DRD1 P21728 1/20 0.35
▸ DRD4 P21917 1/20 0.35
▸ DRD5 P21918 1/20 0.35

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
SCHEMBL4395909 0.89 HTR2C (0.44) HTR2CSLC6A4
SCHEMBL4406792 0.86 JAK2 (0.41) —
SCHEMBL25048390 0.78 BRD4 (0.47) KMONAAAHTR1AL3MBTL1
SCHEMBL4397958 0.78 ACACB (0.42) —
SCHEMBL4404678 0.78 GRM5 (0.49) —
SCHEMBL8635430 0.77 AKT1 (0.44) HDAC2GRM2HTR2CSLC6A4L3MBTL1
SCHEMBL4399211 0.77 ACACB (0.46) —
SCHEMBL4398493 0.77 EPHX2 (0.43) DRD2
SCHEMBL4403349 0.76 LMNA (0.44) —
SCHEMBL7145500 0.76 SLC2A1 (0.39) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10889582-B2 1H-pyrrolo [2,3-b] pyridine derivatives and their use as kinase inhibitors VERNALIS (R&D) LIMITED (GB) 2021-01-12 — — US disclosed
US-20180362526-A1 1H-PYRROLO [2,3-B] PYRIDINE DERIVATIVES AND THEIR USE AS KINASE INHIBITORS VERNALIS DEVELOPMENT LIMITED (GB) 2018-12-20 — — US disclosed
US-10000481-B2 1H-pyrrolo[2,3-B] pyridine derivatives and their use as kinase inhibitors VERNALIS (R&D) LIMITED (GB) 2018-06-19 — — US disclosed
EP-2832726-B1 (2-HETEROARYLAMINO)SUCCINIC ACID DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2017-09-06 — — EP disclosed
EP-2832726-B1 (2-HETEROARYLAMINO)SUCCINIC ACID DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2017-09-06 — — EP disclosed
US-9206168-B2 (2-heteroarylamino) succinic acid derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-12-08 — — US disclosed
US-9206168-B2 (2-heteroarylamino) succinic acid derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-12-08 — — US disclosed
US-9206168-B2 (2-heteroarylamino) succinic acid derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-12-08 — — US disclosed
EP-2832726-A1 (2-HETEROARYLAMINO)SUCCINIC ACID DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-02-04 — — EP disclosed
EP-2832726-A1 (2-HETEROARYLAMINO)SUCCINIC ACID DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-02-04 — — EP disclosed
CN-104334528-A (2-heteroarylamino) succinic acid derivatives DAIICHI SANKYO CO LTD 2015-02-04 — — CN disclosed
US-20150011574-A1 (2-HETEROARYLAMINO) SUCCINIC ACID DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-01-08 — — US disclosed
US-20150011533-A1 1H-PYRROLO[2,3-B] PYRIDINE DERIVATIVES AND THEIR USE AS KINASE INHIBITORS VERNALIS (R&D) LIMITED (GB) 2015-01-08 — — US disclosed
US-20150011574-A1 (2-HETEROARYLAMINO) SUCCINIC ACID DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-01-08 — — US disclosed
US-20150011574-A1 (2-HETEROARYLAMINO) SUCCINIC ACID DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-01-08 — — 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 (5 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-20150011574-A1 (2-HETEROARYLAMINO) SUCCINIC ACID DERIVATIVES EPOR, EGLN2, EGLN3 CETP 3878/4885KMO 1170/4885NAAA 2051/4885
US-10000481-B2 1H-pyrrolo[2,3-B] pyridine derivatives and their use as kinase inhibitors MAP4K2, MAP3K1, MAP3K19 CETP 4866/4885KMO 867/4885NAAA 3971/4885
US-20180362526-A1 1H-PYRROLO [2,3-B] PYRIDINE DERIVATIVES AND THEIR USE AS KINASE INHIBITORS MAP4K2, MAP3K1, MAP3K19 CETP 4866/4885KMO 867/4885NAAA 3971/4885
US-10889582-B2 1H-pyrrolo [2,3-b] pyridine derivatives and their use as kinase inhibitors MAP4K2, MAP3K1, MAP3K19 CETP 4866/4885KMO 867/4885NAAA 3971/4885
US-20150011533-A1 1H-PYRROLO[2,3-B] PYRIDINE DERIVATIVES AND THEIR USE AS KINASE INHIBITORS MAP4K2, MAP3K1, MAP3K19 CETP 4866/4885KMO 867/4885NAAA 3971/4885

“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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