SCHEMBL705905

SCHEMBL705905

O=C(C=Cc1ccccc1)Nc1cccc(F)c1F

nearest known ligand 0.80

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 11/20 0.80
MMP2 P08253 11/20 0.80
MMP9 P14780 11/20 0.80
EGFR P00533 10/20 0.80
MAOB P27338 2/20 0.60
TRPA1 O75762 1/20 0.58
NPC1 O15118 1/20 0.57
MAPT P10636 1/20 0.57
RAB9A P51151 1/20 0.57
MAOA P21397 1/20 0.57
ALDH1A1 P00352 1/20 0.56

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
SCHEMBL705904 1.00 MMP1 (0.80) MMP1MMP2MMP9EGFRMAOB
N-(2-Fluorophenyl)Cinnamamide SCHEMBL1967607 0.89 MMP1 (1.00) MMP1MMP2MMP9EGFRMAOB
N-(2-Fluorophenyl)Cinnamamide SCHEMBL1967609 0.89 MMP1 (1.00) MMP1MMP2MMP9EGFRMAOB
SCHEMBL2821162 0.85 MMP1 (0.76) MMP1MMP2MMP9EGFRMAOB
SCHEMBL30159590 0.85 MMP1 (0.76) MMP1MMP2MMP9EGFRMAOB
SCHEMBL2819694 0.85 MMP1 (0.76) MMP1MMP2MMP9EGFRMAOB
SCHEMBL2821167 0.85 MMP1 (0.76) MMP1MMP2MMP9EGFRMAOB
SCHEMBL3180639 0.85 MMP1 (0.76) MMP1MMP2MMP9EGFRMAOB
SCHEMBL2819695 0.85 MMP1 (0.76) MMP1MMP2MMP9EGFRMAOB
SCHEMBL10492424 0.84 MMP1 (0.80) MMP1MMP2MMP9EGFRMAOB

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-20120108577-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2012-05-03 US disclosed
US-8124602-B2 Compounds for the treatment of multi-drug resistant bacterial infections ASTRAZENECA AB (SE) 2012-02-28 US disclosed
US-20110092495-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2011-04-21 US disclosed
EP-2289890-A1 Compounds for the treatment of multi-drug resistant bacterial infections AstraZeneca AB (SE) 2011-03-02 EP disclosed
US-7875715-B2 6-[({1-[2-(7-methoxy-2-oxoquinoxalin-1(2H)-yl)ethyl]piperidin-4-yl}amino)methyl]-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one; antibacteria; methicillin-resistant Staphylococcus aureus (MRSA), methicillin-resistant coagulase-negative staphylococci (MRCNS), penicillin-resistant Streptococcus pneumoniae ASTRAZENECA AB (SE) 2011-01-25 US disclosed
US-20100152441-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2010-06-17 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 (3 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-20110092495-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS PIGS, BPGM, IPMK MMP1 368/4885MMP2 853/4885MMP9 586/4885
US-20120108577-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS PIGS, BPGM, IPMK MMP1 368/4885MMP2 853/4885MMP9 586/4885
US-20100152441-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS PIGS, BPGM, IPMK MMP1 368/4885MMP2 853/4885MMP9 586/4885

“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.