SCHEMBL1282103

SCHEMBL1282103

CCNC(=O)Nc1nc2cc(OS(=O)(=O)C(F)(F)F)cc(C(=O)NCC)c2s1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 12/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PIK3CD O00329 1/20 0.41
PIK3CA P42336 1/20 0.40
PIK3CG P48736 1/20 0.40

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
SCHEMBL1282766 0.91 ABL1 (0.42) ABL1NPC1RAB9ASMN1; SMN2PIK3CD
SCHEMBL1292371 0.87 ABL1 (0.41) ABL1NPC1RAB9ASMN1; SMN2PIK3CD
SCHEMBL1283113 0.87 ABL1 (0.41) ABL1NPC1RAB9ASMN1; SMN2PIK3CD
SCHEMBL1282966 0.84 ABL1 (0.56) ABL1NPC1RAB9ASMN1; SMN2PIK3CA
SCHEMBL17233338 0.81 PIK3CD (0.33) ABL1PIK3CDPIK3CAPIK3CG
SCHEMBL3662050 0.81 NPC1 (0.56) ABL1NPC1RAB9ASMN1; SMN2PIK3CD
SCHEMBL1282511 0.81 ABL1 (0.43) ABL1NPC1RAB9ASMN1; SMN2PIK3CD
SCHEMBL1282508 0.81 ABL1 (0.43) ABL1NPC1RAB9ASMN1; SMN2PIK3CD
SCHEMBL1282055 0.80 NPC1 (0.47) ABL1NPC1RAB9ASMN1; SMN2PIK3CD
SCHEMBL219364 0.79 ABL1 (0.43) ABL1NPC1RAB9ASMN1; SMN2PIK3CD

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 5 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-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
WO-2012045124-A1 BACTERIA TOPOISOMERASE II INHIBITING 2-ETHYLCARBAMOYLAMINO-1, 3-BENZOTHIAZOL-5-YLS BIOTA EUROPE LTD (GB) 2012-04-12 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 (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 537/4885NPC1 1032/4885RAB9A 915/4885

“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.