SCHEMBL1283035

SCHEMBL1283035

CCNC(=O)Nc1nc2cc(-c3cnc(N4CCC(CC)(C(=O)OCC)CC4)nc3)cc(Br)c2s1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 5/20 0.37
PIK3CG P48736 2/20 0.35
PIK3CA P42336 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL1282970 0.92 ABL1 (0.34) ABL1PIK3CGPIK3CA
SCHEMBL1684969 0.91 ABL1 (0.36) ABL1PIK3CGPIK3CANPC1RAB9A
SCHEMBL1282186 0.91 ABL1 (0.37) ABL1PIK3CGPIK3CANPC1RAB9A
SCHEMBL1282132 0.91 ABL1 (0.38) ABL1PIK3CANPC1RAB9ASMN1; SMN2
SCHEMBL1282693 0.90 ABL1 (0.35) ABL1PIK3CGPIK3CANPC1RAB9A
SCHEMBL1282944 0.90 ABL1 (0.37) ABL1PIK3CGPIK3CA
SCHEMBL1282609 0.89 ABL1 (0.35) ABL1PIK3CGPIK3CA
SCHEMBL1282855 0.89 ABL1 (0.36) ABL1PIK3CGPIK3CA
SCHEMBL1282707 0.87 ABL1 (0.35) ABL1PIK3CGPIK3CA
SCHEMBL1282741 0.87 ABL1 (0.34) ABL1PIK3CGPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181234-B2 Antibacterial compounds BIOTA EUROPE LTD. (GB) 2015-11-10 US disclosed
US-9181234-B2 Antibacterial compounds BIOTA EUROPE LTD. (GB) 2015-11-10 US disclosed
US-9181234-B2 Antibacterial compounds BIOTA EUROPE LTD. (GB) 2015-11-10 US disclosed
US-20120088750-A1 ANTIBACTERIAL COMPOUNDS BIOTA EUROPE LTD. (GB) 2012-04-12 US disclosed
US-20120088750-A1 ANTIBACTERIAL COMPOUNDS BIOTA EUROPE LTD. (GB) 2012-04-12 US disclosed
US-20120088750-A1 ANTIBACTERIAL COMPOUNDS BIOTA EUROPE LTD. (GB) 2012-04-12 US 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-20120088750-A1 ANTIBACTERIAL COMPOUNDS MRPL21, NISCH, LSS ABL1 537/4885PIK3CG 1394/4885PIK3CA 1700/4885

“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.