SCHEMBL19410187

SCHEMBL19410187

C[C@H](C(=O)OC(C)(C)C)n1c(=O)n(CC(C(=O)OCc2ccccc2)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TPSAB1 Q15661 2/20 0.38
▸ TPSD1 Q9BZJ3 2/20 0.38
▸ TPSG1 Q9NRR2 2/20 0.38
▸ POLB P06746 1/20 0.36
▸ MAOA P21397 1/20 0.35
▸ SYK P43405 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ ITGA4 P13612 1/20 0.34
▸ ITGB7 P26010 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL19410217 0.89 TPSAB1 (0.37) TPSAB1TPSD1TPSG1MAOAITGA4
SCHEMBL19410213 0.85 ALDH1A1 (0.43) TPSAB1TPSD1TPSG1POLBSYK
SCHEMBL19410181 0.77 GRIA1 (0.43) MAOA
SCHEMBL19410179 0.77 GRIA1 (0.43) MAOA
SCHEMBL30311905 0.76 L3MBTL1 (0.42) TPSAB1TPSD1TPSG1POLBSYK
SCHEMBL16284728 0.74 SYK (0.50) TPSAB1TPSD1TPSG1POLBSYK
SCHEMBL18171810 0.74 ALDH1A1 (0.49) L3MBTL1
SCHEMBL14744316 0.73 TPSAB1 (0.43) TPSAB1TPSD1TPSG1POLBSYK
SCHEMBL16284729 0.73 L3MBTL1 (0.46) TPSAB1TPSD1TPSG1POLBSYK
SCHEMBL17369164 0.73 SYK (0.46) TPSAB1TPSD1TPSG1POLBSYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3440097-B1 MACROCYCLIC INHIBITORS OF THE PD-1/PD-L1 AND CD80/PD-L1 PROTEIN/PROTEIN INTERACTIONS BRISTOL MYERS SQUIBB CO (US) 2024-10-23 — — EP disclosed
US-10358463-B2 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2019-07-23 — — US disclosed
US-10358463-B2 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2019-07-23 — — US disclosed
EP-3440097-A1 MACROCYCLIC INHIBITORS OF THE PD-1/PD-L1 AND CD80/PD-L1 PROTEIN/PROTEIN INTERACTIONS Bristol-Myers Squibb Company (US) 2019-02-13 — — EP disclosed
WO-2017176608-A1 MACROCYCLIC INHIBITORS OF THE PD-1/PD-L1 AND CD80/PD-L1 PROTEIN/PROTEIN INTERACTIONS BRISTOL-MYERS SQUIBB COMPANY (US) 2017-10-12 — — WO disclosed
WO-2017176608-A1 MACROCYCLIC INHIBITORS OF THE PD-1/PD-L1 AND CD80/PD-L1 PROTEIN/PROTEIN INTERACTIONS BRISTOL-MYERS SQUIBB COMPANY (US) 2017-10-12 — — WO disclosed
US-20170283463-A1 IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY 2017-10-05 — — US disclosed
US-20170283463-A1 IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY 2017-10-05 — — US disclosed
US-20170283463-A1 IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY 2017-10-05 — — 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 (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-20170283463-A1 IMMUNOMODULATORS CD274, PDCD1, PDCD1LG2 TPSAB1 2689/4885TPSD1 3326/4885TPSG1 1138/4885
US-10358463-B2 Immunomodulators CD274, PDCD1, PDCD1LG2 TPSAB1 2689/4885TPSD1 3326/4885TPSG1 1138/4885

“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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