SCHEMBL7090716

SCHEMBL7090716

CC(C)(C)OC(=O)N1C(=O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1c1ccncc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.38
GPR119 Q8TDV5 8/20 0.34
USP30 Q70CQ3 1/20 0.32
RIPK1 Q13546 1/20 0.31
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 1/20 0.30
GRM1 Q13255 1/20 0.30
KDM4D Q6B0I6 2/20 0.30
KLK7 P49862 1/20 0.30

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
SCHEMBL7090714 1.00 ELANE (0.38) ELANEGPR119USP30RIPK1PDE4A
SCHEMBL7090713 1.00 ELANE (0.38) ELANEGPR119USP30RIPK1PDE4A
SCHEMBL7092475 0.89 ELANE (0.47) ELANEGPR119RIPK1KLK7
SCHEMBL7089023 0.89 ELANE (0.47) ELANEGPR119RIPK1KLK7
SCHEMBL6853154 0.85 ELANE (0.37) ELANEGPR119RIPK1PDE4APDE4B
SCHEMBL6853151 0.85 ELANE (0.37) ELANEGPR119RIPK1PDE4APDE4B
SCHEMBL6853156 0.85 ELANE (0.37) ELANEGPR119RIPK1PDE4APDE4B
SCHEMBL3083528 0.79 ELANE (0.49) ELANEGPR119RIPK1KLK7
SCHEMBL3083530 0.79 ELANE (0.49) ELANEGPR119RIPK1KLK7
SCHEMBL3082464 0.79 ELANE (0.49) ELANEGPR119RIPK1KLK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6646123-B2 Antitumor DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-11-11 US disclosed
US-20030162971-A1 Pentacyclic compound DAIICHI PHARMACEUTICAL CO., LTD. 2003-08-28 US disclosed
US-6545151-B2 Taxol derivative; antitumor agents DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-04-08 US disclosed
US-20010041796-A1 Pentacyclic compound TERASAWA HIROFUMI (JP) 2001-11-15 US disclosed
EP-0826688-B1 PENTACYCLIC COMPOUNDS DAIICHI SEIYAKU CO (JP) 2001-09-05 EP disclosed
US-6211363-B1 TAXANE COMPOUNDS; ANTITUMOR AGENTS DAIICHI PHARAMACEUTICAL CO., LTD. (JP) 2001-04-03 US disclosed
US-6075140-A A TAXOL DERIVATIVE CONTAINING PENTACYCLIC RING IN WHICH 9 AND 10 POSITION HYDROXYL GROUP ARE CHANGED TO CYCLIC ACETAL GROUP IS USEFUL AS ANTITUMOR AGENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-06-13 US disclosed
EP-0826688-A1 PENTACYCLIC COMPOUNDS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1998-03-04 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 (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-20030162971-A1 Pentacyclic compound RPL31, OXER1, BCOR ELANE 4110/4885GPR119 1349/4885USP30 1428/4885
US-20010041796-A1 Pentacyclic compound RPL31, BCOR, OXER1 ELANE 4117/4885GPR119 1434/4885USP30 1427/4885

“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.