SCHEMBL15260276

SCHEMBL15260276

CCNC(=O)Nc1nc2cc(-c3cnc(C(C)(C)O)nc3)c(OCc3ccc(OC)c(OC)c3)cc2s1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 12/20 0.50
▸ PIK3CA P42336 1/20 0.45
▸ PIK3CG P48736 1/20 0.45
▸ AURKB Q96GD4 2/20 0.42
▸ YES1 P07947 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HIPK1 Q86Z02 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ PIK3CD O00329 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
SCHEMBL15260016 0.89 ABL1 (0.59) ABL1PIK3CAPIK3CGPIK3CD
SCHEMBL19159954 0.87 MAPK1 (0.41) ABL1PIK3CAAURKBYES1MAPK1
SCHEMBL15260115 0.84 ABL1 (0.50) ABL1PIK3CAPIK3CGPIK3CD
SCHEMBL15260152 0.84 ABL1 (0.51) ABL1PIK3CAPIK3CGPIK3CD
SCHEMBL15260275 0.81 ABL1 (0.48) ABL1
SCHEMBL15260227 0.79 PIK3CD (0.48) ABL1PIK3CAPIK3CGPIK3CD
SCHEMBL15260045 0.77 ABL1 (0.51) ABL1PIK3CAAURKB
SCHEMBL15260028 0.77 KDM4E (0.46) ABL1MAPK1MAPT
SCHEMBL15260177 0.77 ABL1 (0.45) ABL1PIK3CAPIK3CGPIK3CD
SCHEMBL15260205 0.77 ABL1 (0.45) ABL1PIK3CAPIK3CGPIK3CD

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170260178-A1 ANTIBACTERIAL COMPOUNDS SPERO GYRASE INC (US) 2017-09-14 — — US claimed
US-20170007615-A1 Antibacterial Compounds SPERO GYRASE, INC. 2017-01-12 — — US claimed
US-20150329530-A1 ANTIBACTERIAL COMPUNDS SPERO GYRASE, INC. 2015-11-19 — — US claimed
US-8906902-B2 Antibacterial compounds BIOTA EUROPE LIMITED (GB) 2014-12-09 — — US claimed
US-20130252938-A1 Antibacterial Compounds BIOTA EUROPE LTD. (GB) 2013-09-26 — — US claimed
US-20170260178-A1 ANTIBACTERIAL COMPOUNDS SPERO GYRASE INC (US) 2017-09-14 — — US disclosed
US-20170260178-A1 ANTIBACTERIAL COMPOUNDS SPERO GYRASE INC (US) 2017-09-14 — — US disclosed
US-20170260178-A1 ANTIBACTERIAL COMPOUNDS SPERO GYRASE INC (US) 2017-09-14 — — US disclosed
EP-2828257-B1 ANTIBACTERIAL COMPOUNDS BIOTA EUROPE LTD (GB) 2017-07-26 — — EP disclosed
EP-2828257-B1 ANTIBACTERIAL COMPOUNDS BIOTA EUROPE LTD (GB) 2017-07-26 — — EP disclosed
US-9604976-B2 Antibacterial compounds SPERO GYRASE, INC. (US) 2017-03-28 — — US disclosed
US-9604976-B2 Antibacterial compounds SPERO GYRASE, INC. (US) 2017-03-28 — — US disclosed
US-20150329530-A1 ANTIBACTERIAL COMPUNDS SPERO GYRASE, INC. 2015-11-19 — — US disclosed
US-8906902-B2 Antibacterial compounds BIOTA EUROPE LIMITED (GB) 2014-12-09 — — US disclosed
US-8906902-B2 Antibacterial compounds BIOTA EUROPE LIMITED (GB) 2014-12-09 — — US disclosed
US-8906902-B2 Antibacterial compounds BIOTA EUROPE LIMITED (GB) 2014-12-09 — — US disclosed
US-20130252938-A1 Antibacterial Compounds BIOTA EUROPE LTD. (GB) 2013-09-26 — — US disclosed
US-20130252938-A1 Antibacterial Compounds BIOTA EUROPE LTD. (GB) 2013-09-26 — — US disclosed
US-20130252938-A1 Antibacterial Compounds BIOTA EUROPE LTD. (GB) 2013-09-26 — — US disclosed
WO-2013138860-A1 ANTIBACTERIAL COMPOUNDS BIOTA EUROPE LIMITED (GB) 2013-09-26 — — 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 (4 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-20170260178-A1 ANTIBACTERIAL COMPOUNDS STS, PGLS, PEPD ABL1 1389/4885PIK3CA 204/4885PIK3CG 282/4885
US-20150329530-A1 ANTIBACTERIAL COMPUNDS STS, PEPD, PGLS ABL1 1764/4885PIK3CA 512/4885PIK3CG 617/4885
US-20170007615-A1 Antibacterial Compounds CLPP, MRPL21, RELA ABL1 294/4885PIK3CA 994/4885PIK3CG 426/4885
US-20130252938-A1 Antibacterial Compounds STS, PGLS, PEPD ABL1 1389/4885PIK3CA 204/4885PIK3CG 282/4885

“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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