SCHEMBL17747073

SCHEMBL17747073

CC(C)(C)OC(=O)CCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCCOCCOCCOCCCNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.47
▸ TLR2 O60603 3/20 0.46
▸ BCHE P06276 2/20 0.43
▸ ACHE P22303 2/20 0.43
▸ TLR1 Q15399 1/20 0.43
▸ MAPT P10636 2/20 0.42
▸ KLK7 P49862 1/20 0.40
▸ KLK5 Q9Y337 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ ITGB3 P05106 1/20 0.39
▸ ITGA2B P08514 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ PTPN1 P18031 1/20 0.38

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
SCHEMBL19990738 1.00 KMT2A (0.47) KMT2ATLR2BCHEACHETLR1
SCHEMBL17751722 1.00 KMT2A (0.47) KMT2ATLR2BCHEACHETLR1
SCHEMBL17747070 1.00 KMT2A (0.47) KMT2ATLR2BCHEACHETLR1
SCHEMBL29602180 1.00 KMT2A (0.47) KMT2ATLR2BCHEACHETLR1
SCHEMBL29602153 1.00 KMT2A (0.47) KMT2ATLR2BCHEACHETLR1
SCHEMBL17747030 0.94 KMT2A (0.49) KMT2ATLR2BCHEACHETLR1
SCHEMBL17747027 0.94 KMT2A (0.49) KMT2ATLR2BCHEACHETLR1
SCHEMBL17760452 0.92 BCHE (0.41) KMT2ATLR2BCHEACHETLR1
SCHEMBL17747060 0.92 TLR2 (0.54) KMT2ATLR2BCHEACHETLR1
SCHEMBL17746948 0.92 TLR2 (0.54) KMT2ATLR2BCHEACHETLR1

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-11952434-B2 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2024-04-09 — — US disclosed
US-20230101323-A1 IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-03-30 — — US disclosed
US-11358988-B2 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2022-06-14 — — US disclosed
US-11358988-B2 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2022-06-14 — — US disclosed
EP-3778622-A1 MACROCYCLIC PEPTIDES USEFUL AS IMMUNOMODULATORS Bristol-Myers Squibb Company (US) 2021-02-17 — — EP disclosed
EP-3218392-B1 MACROCYCLIC PEPTIDES USEFUL AS IMMUNOMODULATORS BRISTOL MYERS SQUIBB CO (US) 2020-07-29 — — EP disclosed
US-20200216498-A1 IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2020-07-09 — — US disclosed
US-20200216498-A1 IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2020-07-09 — — US disclosed
US-10633419-B2 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2020-04-28 — — US disclosed
US-10633419-B2 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2020-04-28 — — US disclosed
US-20180086793-A1 IMMUNOMODULATORS BRISTOL MYERS SQUIBB CO (US) 2018-03-29 — — US disclosed
US-20180086793-A1 IMMUNOMODULATORS BRISTOL MYERS SQUIBB CO (US) 2018-03-29 — — US disclosed
US-9856292-B2 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2018-01-02 — — US disclosed
US-20160137696-A1 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY 2016-05-19 — — US disclosed
WO-2016077518-A1 MACROCYCLIC PEPTIDES USEFUL AS IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2016-05-19 — — 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-11952434-B2 Immunomodulators CD74, ICOS, HAVCR2 KMT2A 3513/4885TLR2 91/4885BCHE 2004/4885
US-20160137696-A1 Immunomodulators CD74, ICOS, HAVCR2 KMT2A 3513/4885TLR2 91/4885BCHE 2004/4885
US-20230101323-A1 IMMUNOMODULATORS CD74, ICOS, HAVCR2 KMT2A 3513/4885TLR2 91/4885BCHE 2004/4885
US-10633419-B2 Immunomodulators CD74, ICOS, HAVCR2 KMT2A 3513/4885TLR2 91/4885BCHE 2004/4885
US-11358988-B2 Immunomodulators CD74, ICOS, HAVCR2 KMT2A 3513/4885TLR2 91/4885BCHE 2004/4885
US-20180086793-A1 IMMUNOMODULATORS CD74, ICOS, HAVCR2 KMT2A 3513/4885TLR2 91/4885BCHE 2004/4885
US-20200216498-A1 IMMUNOMODULATORS CD74, ICOS, HAVCR2 KMT2A 3513/4885TLR2 91/4885BCHE 2004/4885

“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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