SCHEMBL5886280

SCHEMBL5886280

COC(=O)c1c(F)ccc2nc3ccc4c(OC)cccc4c3nc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.39
SRC P12931 1/20 0.39
PLA2G2A P14555 3/20 0.38
FABP4 P15090 1/20 0.38
DHODH Q02127 1/20 0.38
NQO2 P16083 1/20 0.38
KMT2A Q03164 5/20 0.37
MEN1 O00255 4/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ADORA2A P29274 1/20 0.37
GAA P10253 1/20 0.37
THRB P10828 1/20 0.37
RECQL P46063 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NCEH1 Q6PIU2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL5886242 0.87 IDO1 (0.40) NQO2KMT2AMEN1KDM4EMAPT
SCHEMBL5886358 0.85 NQO2 (0.37) PLA2G2ANQO2KMT2AMEN1KDM4E
SCHEMBL5886260 0.81 KMT2A (0.51) PLA2G2ADHODHNQO2KMT2AMEN1
SCHEMBL5886247 0.80 CA12 (0.51) NQO2KMT2AMEN1KDM4EMAPT
SCHEMBL5886404 0.78 CA12 (0.45) NQO2KMT2AMEN1KDM4EMAPT
SCHEMBL5886264 0.78 CA12 (0.42) FABP4NQO2KMT2AMEN1KDM4E
SCHEMBL5886266 0.77 CA12 (0.44) NQO2KMT2AMEN1KDM4EMAPT
SCHEMBL5886271 0.75 ALDH1A1 (0.54) FABP4DHODHNQO2KMT2AMEN1
SCHEMBL1649420 0.73 NQO2 (0.69) NQO2KMT2AMEN1KDM4EMAPT
SCHEMBL5886319 0.73 ALDH1A1 (0.46) DHODHNQO2KMT2AMEN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7132419-B2 Pharmaceutical compounds XENOVA LIMITED (GB) 2006-11-07 US disclosed
US-20050143383-A1 Pharmaceutical compounds XENOVA LIMITED (GB) 2005-06-30 US disclosed
US-20030139409-A1 Benzo[A] [phenazin-11-carboxamide derivatives and their use as joint inhibitors of topomerase I and II XENOVA LIMITED (GB) 2003-07-24 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-20050143383-A1 Pharmaceutical compounds CHRNA10, OPRM1, SCN10A ABL1 2922/4885SRC 2642/4885PLA2G2A 3596/4885
US-20030139409-A1 Benzo[A] [phenazin-11-carboxamide derivatives and their use as joint inhibitors of topomerase I and II TOP1, TOP2A, TOP2B ABL1 2582/4885SRC 2591/4885PLA2G2A 4662/4885

“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.