SCHEMBL368528

SCHEMBL368528

COC(=O)c1nc2c(N3CCCOC3=O)cc(N(C)C)cn2c(=O)c1OCc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
NAAA Q02083 3/20 0.35
FAAH O00519 1/20 0.35
ALDH1A1 P00352 2/20 0.34
USP2 O75604 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
GRM5 P41594 1/20 0.33
MAPT P10636 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
NOX1 Q9Y5S8 1/20 0.33
ABCC1 P33527 1/20 0.32
KDM1A O60341 2/20 0.32
TP53 P04637 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
SCHEMBL368773 0.95 NAAA (0.38) LMNAHPGDNAAAFAAHALDH1A1
SCHEMBL369721 0.89 LMNA (0.38) LMNAHPGDNAAAFAAHALDH1A1
SCHEMBL10071004 0.87
SCHEMBL368547 0.87 MAPK1 (0.39) LMNAHPGDALDH1A1USP2TSHR
SCHEMBL369231 0.87 LMNA (0.38) LMNAHPGDALDH1A1TSHRHSD17B10
SCHEMBL1222284 0.85 LMNA (0.38) LMNAHPGDALDH1A1USP2TSHR
SCHEMBL367738 0.84 NAAA (0.39) LMNAHPGDNAAAFAAHALDH1A1
SCHEMBL15097362 0.84 LMNA (0.37) LMNAHPGDALDH1A1USP2TSHR
SCHEMBL368792 0.83 LMNA (0.38) LMNAHPGDNAAAFAAHALDH1A1
SCHEMBL1221123 0.83 MRGPRX4 (0.43) LMNAHPGDNAAAFAAHALDH1A1

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 2087/4885NAAA 1747/4885

“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.