SCHEMBL369238

SCHEMBL369238

COC(=O)c1nc2c(N3CCN(C)C3=O)cc(Br)cn2c(=O)c1OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 2/20 0.34
ALDH1A1 P00352 2/20 0.34
TSHR P16473 2/20 0.34
USP2 O75604 1/20 0.34
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
FAAH O00519 1/20 0.34
CNR2 P34972 1/20 0.34
MAPK8 P45983 3/20 0.33
NOTUM Q6P988 1/20 0.33
KDM1A O60341 3/20 0.33
GAA P10253 1/20 0.33
MCL1 Q07820 1/20 0.32

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
SCHEMBL369582 0.90 LMNA (0.38) LMNAHPGDTP53MAPTKDM4E
SCHEMBL15097284 0.89 LMNA (0.38) LMNAHPGDTP53MAPTKDM4E
SCHEMBL1222284 0.89 LMNA (0.38) LMNAHPGDTP53MAPTHSD17B10
SCHEMBL369332 0.87 LMNA (0.41) LMNAHPGDTP53MAPTKDM4E
SCHEMBL10070422 0.86 TLR7 (0.31)
SCHEMBL367738 0.86 NAAA (0.39) LMNAHPGDTP53MAPTHSD17B10
SCHEMBL368995 0.86 HPGD (0.41) LMNAHPGDTP53MAPTKDM4E
SCHEMBL369345 0.86 MRGPRX4 (0.43) LMNAHPGDMAPTKDM4EHSD17B10
SCHEMBL369721 0.85 LMNA (0.38) LMNAHPGDTP53MAPTKDM4E
SCHEMBL368771 0.84 LMNA (0.35) LMNAHPGDTP53MAPTHSD17B10

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-20130178469-A1 NOVEL ANTIVIRAL AGENTS SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY (SIOC) (CN) 2013-07-11 US disclosed
US-20130178469-A1 NOVEL ANTIVIRAL AGENTS SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY (SIOC) (CN) 2013-07-11 US disclosed
EP-2593460-A1 7, 9-NITROGEN RADICAL-4-OXO-4H-PYRIDO[L,2-A]PYRIMIDINE-2-CARBOXYLIC ACID BENZYLAMIDE ANTI-VIRALS Avexa Limited (AU) 2013-05-22 EP disclosed
WO-2012006680-A1 7, 9-NITROGEN RADICAL-4-OXO-4H-PYRIDO[L,2-A]PYRIMIDINE-2-CARBOXYLIC ACID BENZYLAMIDE ANTI-VIRALS AVEXA LIMITED (AU) 2012-01-19 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-20130178469-A1 NOVEL ANTIVIRAL AGENTS EIF2AK2, IFNAR1, IRF3 LMNA 4293/4885HPGD 2087/4885TP53 3404/4885

“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.