SCHEMBL352373

SCHEMBL352373

COc1c(C(=O)NC2=CC(=O)C3OC3C2OC(=O)C(F)(F)F)ccc2cccnc12

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 8/20 0.40
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
RAB9A P51151 3/20 0.36
POLB P06746 3/20 0.36
MAPT P10636 1/20 0.36
PARK7 Q99497 1/20 0.36
HPGD P15428 1/20 0.35
NPC1 O15118 1/20 0.35
HDAC8 Q9BY41 1/20 0.33

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
Trifluoroacetic Acid SCHEMBL352372 0.85 PARK7 (0.45) EGLN1MEN1KMT2ARAB9APOLB
SCHEMBL353833 0.84 BRD4 (0.38) MEN1KMT2APOLBMAPTPARK7
SCHEMBL351183 0.84 PARK7 (0.50) EGLN1MEN1KMT2ARAB9APOLB
SCHEMBL352567 0.81 BRD4 (0.39) MEN1KMT2ARAB9APARK7NPC1
SCHEMBL351941 0.78 TLR7 (0.40) PARK7
SCHEMBL16649994 0.76 SSTR4 (0.32)
SCHEMBL352796 0.74 EGLN1 (0.47) EGLN1MEN1KMT2ARAB9APOLB
SCHEMBL168258 0.73 KLKB1 (0.39) MEN1KMT2AMAPTPARK7HPGD
Trifluoroacetic Acid SCHEMBL353832 0.69 PARK7 (0.45) MEN1KMT2APOLBMAPTPARK7
SCHEMBL351942 0.67 PARK7 (0.45) PARK7

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
EP-2411376-B1 INHIBITORS OF NF-KB PROFECTUS BIOSCIENCES INC (US) 2015-04-22 EP claimed
US-8629164-B2 Inhibitors of NF-κB PROFECTUS BIOSCIENCES, INC. (US) 2014-01-14 US claimed
US-20120015952-A1 Inhibitors of NF-KB PROFECTUS BIOSCIENCES, INC. (US) 2012-01-19 US claimed
EP-2411376-B1 INHIBITORS OF NF-KB PROFECTUS BIOSCIENCES INC (US) 2015-04-22 EP disclosed
US-8629164-B2 Inhibitors of NF-κB PROFECTUS BIOSCIENCES, INC. (US) 2014-01-14 US disclosed
US-20120015952-A1 Inhibitors of NF-KB PROFECTUS BIOSCIENCES, INC. (US) 2012-01-19 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-20120015952-A1 Inhibitors of NF-KB NFKBIA, IKBKB, IKBKG EGLN1 3912/4885MEN1 2854/4885KMT2A 2968/4885

“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.