SCHEMBL3326304

SCHEMBL3326304

CN(CC(=O)NCC1CC(c2ccc(Br)cc2)=NO1)C1CC(c2ccc(Br)cc2)=NO1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 2/20 0.44
LMNA P02545 1/20 0.43
MIF P14174 9/20 0.42
HDAC6 Q9UBN7 1/20 0.42
F2 P00734 1/20 0.41
F10 P00742 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 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
SCHEMBL3328210 0.88 MIF (0.46) RAB9ASMN1; SMN2NPC1MIFHDAC6
SCHEMBL3325175 0.82 RAB9A (0.34) RAB9ASMN1; SMN2NPC1LMNAMIF
SCHEMBL7506811 0.81 RAB9A (0.52) RAB9ASMN1; SMN2NPC1LMNAMIF
SCHEMBL4917774 0.74 FPR3 (0.38) RAB9ASMN1; SMN2NPC1LMNAMIF
SCHEMBL12294017 0.70 LMNA (0.51) RAB9ASMN1; SMN2NPC1LMNAMIF
SCHEMBL1002307 0.70 F10 (0.46) RAB9ASMN1; SMN2NPC1LMNAF10
SCHEMBL4951608 0.69 LMNA (0.53) RAB9ASMN1; SMN2NPC1LMNAMIF
SCHEMBL3326724 0.69 LMNA (0.53) RAB9ASMN1; SMN2NPC1LMNAMIF
SCHEMBL3326726 0.69 LMNA (0.53) RAB9ASMN1; SMN2NPC1LMNAMIF
SCHEMBL14183673 0.69 MIF (0.58) SMN1; SMN2LMNAMIFHDAC6F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137243-A1 Oxazolidinone And/Or Isoxazoline As Antibacterial Agents ASTRAZENECA AB (SE) 2010-06-03 US disclosed
US-7396847-B2 Oxazolidinone and/or isoxazoline as antibacterial agents ASTRAZENECA AB (SE) 2008-07-08 US disclosed
EP-1427711-B1 OXAZOLIDINONE AND/OR ISOXAZOLINE DERIVATIVES AS ANTIBACTERIAL AGENTS ASTRAZENECA AB (SE) 2005-07-13 EP disclosed
US-20050107435-A1 Oxazolidinone and/or isoxazoline as antibacterial agents ASTRAZENECA AB (SE) 2005-05-19 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 (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-20100137243-A1 Oxazolidinone And/Or Isoxazoline As Antibacterial Agents CYP8B1, HRH2, CYP2W1 RAB9A 2624/4885SMN1; SMN2 2447/4885NPC1 3306/4885
US-20050107435-A1 Oxazolidinone and/or isoxazoline as antibacterial agents CYP8B1, CYP2W1, HRH2 RAB9A 2781/4885SMN1; SMN2 2320/4885NPC1 3309/4885

“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.