SCHEMBL1477844

SCHEMBL1477844

O=C(NC1CC1)c1ccc(Oc2ccc([N+](=O)[O-])nc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ST14 Q9Y5Y6 8/20 0.48
F2 P00734 6/20 0.46
PRSS1 P07477 5/20 0.46
PRSS2 P07478 5/20 0.46
PRSS3 P35030 5/20 0.46
PLG P00747 2/20 0.46
NPC1 O15118 5/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.42
ALDH1A1 P00352 1/20 0.42
NAAA Q02083 1/20 0.42
RAB9A P51151 3/20 0.42
MAPT P10636 1/20 0.42
F10 P00742 1/20 0.42
HPGDS O60760 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HPGD P15428 1/20 0.41
POLB P06746 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
SCHEMBL12749172 0.82 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL1477719 0.80 ST14 (0.69) ST14F2PRSS1PRSS2PRSS3
SCHEMBL851395 0.78 SCN9A (0.45) ST14F2PRSS1PRSS2PRSS3
SCHEMBL1478278 0.78 PARP10 (0.56) ST14F2PRSS1PRSS2PRSS3
SCHEMBL1478206 0.76 KMT2A (0.51) LMNASMN1; SMN2ALDH1A1RAB9AMAPT
SCHEMBL851333 0.76 ST14 (0.43) ST14F2PRSS1PRSS2PRSS3
SCHEMBL1477988 0.74 SMN1; SMN2 (0.40) NPC1LMNASMN1; SMN2ALDH1A1RAB9A
SCHEMBL14949667 0.73 MAPT (0.51) NPC1LMNASMN1; SMN2ALDH1A1RAB9A
SCHEMBL14949664 0.73 MAPT (0.51) NPC1LMNASMN1; SMN2ALDH1A1RAB9A
SCHEMBL2659166 0.72 PIN1 (0.47) LMNAALDH1A1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7915295-B2 Viricides; HIV antivirals effective against problematic drug escape mutants; N-[(1S,1aR,7bR)-4,7-difluoro-1,1a,2,7b-tetrahydrocyclopropa[c]chromen-1-yl]-N'-[5-(4-(sulfonamido)phenoxy)-2-pyridinyl]urea MEDIVIR AB (SE) 2011-03-29 US disclosed
US-7915295-B2 Viricides; HIV antivirals effective against problematic drug escape mutants; N-[(1S,1aR,7bR)-4,7-difluoro-1,1a,2,7b-tetrahydrocyclopropa[c]chromen-1-yl]-N'-[5-(4-(sulfonamido)phenoxy)-2-pyridinyl]urea MEDIVIR AB (SE) 2011-03-29 US disclosed
EP-1701942-B1 NON-NUCLEOTIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2009-12-09 EP disclosed
EP-1701942-B1 NON-NUCLEOTIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2009-12-09 EP disclosed
US-20080070951-A1 Non-Nucleotide Reverse Transcriptase Inhibitors MEDIVIR AB (SE) 2008-03-20 US disclosed
US-20080070951-A1 Non-Nucleotide Reverse Transcriptase Inhibitors MEDIVIR AB (SE) 2008-03-20 US disclosed
US-20080070951-A1 Non-Nucleotide Reverse Transcriptase Inhibitors MEDIVIR AB (SE) 2008-03-20 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-20080070951-A1 Non-Nucleotide Reverse Transcriptase Inhibitors RCOR1, RRM2, POLR1A ST14 3349/4885F2 4229/4885PRSS1 1543/4885

“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.