SCHEMBL6287020

SCHEMBL6287020

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 7/20 0.48
CA2 P00918 7/20 0.48
KMT2A Q03164 2/20 0.44
GAA P10253 2/20 0.44
MEN1 O00255 1/20 0.44
TDP1 Q9NUW8 5/20 0.43
MAPT P10636 4/20 0.43
KDM4E B2RXH2 3/20 0.43
NPSR1 Q6W5P4 3/20 0.43
CA12 O43570 3/20 0.42
CA9 Q16790 3/20 0.42
SPHK1 Q9NYA1 1/20 0.42
GLA P06280 1/20 0.42
PAX8 Q06710 1/20 0.42
FPR3 P25089 2/20 0.42
FPR2 P25090 2/20 0.42
ANPEP P15144 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
LTA4H P09960 1/20 0.41

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
SCHEMBL6287916 1.00 CA1 (0.48) CA1CA2KMT2AGAAMEN1
SCHEMBL4599955 0.90 TDP1 (0.52) CA1CA2KMT2AGAAMEN1
SCHEMBL4599951 0.90 TDP1 (0.52) CA1CA2KMT2AGAAMEN1
SCHEMBL17592256 0.89 CA1 (0.48) CA1CA2KMT2AGAAMEN1
SCHEMBL20067638 0.88 SPHK1 (0.49) CA1CA2KMT2AGAAMEN1
SCHEMBL30746081 0.85 DPP8 (0.48) CA1CA2KMT2AMEN1MAPT
SCHEMBL2928021 0.85 MEN1 (0.53) CA1CA2KMT2AGAAMEN1
SCHEMBL21097234 0.84 ANPEP (0.49) CA1CA2KMT2AGAATDP1
SCHEMBL6287144 0.83 SPHK1 (0.47) CA1CA2CA12CA9SPHK1
SCHEMBL19931686 0.82 CA1 (0.49) CA1CA2KMT2AGAAMEN1

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 4718/4885KMT2A 2704/4885

“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.