SCHEMBL353833

SCHEMBL353833

COc1ncccc1C(=O)NC1=CC(=O)C2OC2C1OC(=O)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.38
BRPF1 P55201 1/20 0.38
PPARG P37231 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
NCOR2 Q9Y618 1/20 0.38
MAP3K5 Q99683 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
NPC1 O15118 1/20 0.36
TSHR P16473 1/20 0.36
ALDH1A1 P00352 3/20 0.36
POLB P06746 1/20 0.36
TAS2R8 Q9NYW2 1/20 0.35
GAA P10253 3/20 0.35
MAPT P10636 1/20 0.35
ABL1 P00519 1/20 0.35
PARK7 Q99497 1/20 0.35
GPR6 P46095 4/20 0.35
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL352567 0.86 BRD4 (0.39) BRD4BRPF1NPC1ALDH1A1GAA
SCHEMBL352373 0.84 EGLN1 (0.40) NPC1POLBMAPTPARK7HPGD
Trifluoroacetic Acid SCHEMBL353832 0.84 PARK7 (0.45) BRD4BRPF1PPARGRXFP1NCOR2
SCHEMBL16649994 0.83 SSTR4 (0.32)
SCHEMBL351941 0.82 TLR7 (0.40) PARK7
SCHEMBL353842 0.82 PARK7 (0.50) BRD4BRPF1PPARGRXFP1NCOR2
SCHEMBL168258 0.75 KLKB1 (0.39) NPC1ALDH1A1MAPTPARK7HPGD
SCHEMBL354123 0.71 BRD4 (0.44) BRD4BRPF1PPARGRXFP1NCOR2
SCHEMBL351903 0.69 PARK7 (0.45) BRD4BRPF1TSHRALDH1A1MAPT
SCHEMBL351942 0.69 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 BRD4 1058/4885BRPF1 2485/4885PPARG 1856/4885

“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.