SCHEMBL6287650

SCHEMBL6287650

CC(C)(C)OC(=O)NCCCC[C@@](N)(C(=O)Nc1ccc(C(c2ccc(NC(=O)[C@](N)(CCCCNC(=O)OC(C)(C)C)C(=O)c3ccccc3O)cc2)c2ccc(NC(=O)[C@](N)(CCCCNC(=O)OC(C)(C)C)C(=O)c3ccccc3O)cc2)cc1)C(=O)c1ccccc1O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 7/20 0.43
CA2 P00918 7/20 0.43
CA12 O43570 4/20 0.38
CA9 Q16790 4/20 0.38
NAMPT P43490 1/20 0.37
ACHE P22303 1/20 0.36
BACE1 P56817 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
FPR3 P25089 2/20 0.36
FPR2 P25090 2/20 0.36
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
PTPN1 P18031 2/20 0.35
DRD2 P14416 1/20 0.35
NAAA Q02083 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
SCHEMBL6283057 0.88 CA1 (0.42) CA1CA2CA12CA9NAMPT
SCHEMBL6284054 0.82 RAB9A (0.42) CA1CA2NAMPTMAPT
SCHEMBL6286884 0.81 CYP3A4 (0.45) CA1CA2NAMPTMAPTNPSR1
SCHEMBL6291032 0.80 CA1 (0.39) CA1CA2CA12CA9NAMPT
SCHEMBL6287122 0.80 CA1 (0.41) CA1CA2CA12CA9NAMPT
SCHEMBL6290355 0.79 CTSS (0.46) TDP1MAPTPTPN1
SCHEMBL6287033 0.79 CA1 (0.48) CA1CA2CA12CA9NAMPT
SCHEMBL6287974 0.78 KMT2A (0.43) CA1CA2TDP1MAPTNPSR1
SCHEMBL6286738 0.78 KMT2A (0.43) CA1CA2TDP1MAPTNPSR1
SCHEMBL6287996 0.78 CTSL (0.41) CA1CA2ACHETDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887890-B2 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-05-03 US disclosed
US-20030162724-A1 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-28 US disclosed
EP-1291341-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-12 EP 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 (1 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-20030162724-A1 Compounds exhibiting thrombopoietin-like activities MPL, THPO, TEK CA1 4805/4885CA2 4718/4885CA12 4673/4885

“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.