SCHEMBL6290638

SCHEMBL6290638

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

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
S1PR1 P21453 6/20 0.38
S1PR3 Q99500 4/20 0.38
S1PR4 O95977 2/20 0.37
S1PR5 Q9H228 2/20 0.37
CNR1 P21554 1/20 0.36
CYP17A1 P05093 2/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HDAC8 Q9BY41 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
SCHEMBL6286636 0.79 L3MBTL1 (0.43) L3MBTL1S1PR1S1PR3CYP17A1CA12
SCHEMBL6286634 0.76 S1PR1 (0.43) S1PR1S1PR3
SCHEMBL6288079 0.75 CA1 (0.43) L3MBTL1S1PR1S1PR3CA12CA1
SCHEMBL6290636 0.74 S1PR1 (0.45) S1PR1S1PR3S1PR4S1PR5HDAC8
SCHEMBL7208629 0.73 L3MBTL1 (0.35) L3MBTL1S1PR1S1PR3S1PR4S1PR5
SCHEMBL7210568 0.73 L3MBTL1 (0.35) L3MBTL1S1PR1S1PR3S1PR4S1PR5
SCHEMBL4030831 0.69 CYP17A1 (0.46) CYP17A1CA12CA1CA2CA9
SCHEMBL31409238 0.68 CYP17A1 (0.46) CYP17A1CA12CA1CA9
SCHEMBL6286561 0.67 ROCK2 (0.43) L3MBTL1CA12CA1CA2CA7
SCHEMBL26814989 0.67 HPGD (0.56) L3MBTL1HPGDSMN1; SMN2HDAC8

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 L3MBTL1 1806/4885S1PR1 1281/4885S1PR3 1632/4885

“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.