SCHEMBL17754237

SCHEMBL17754237

COc1cc(OC)c2c(=O)[nH]c(-c3ccc(N4CCN(C(C)C)CC4)cc3)nc2n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
HPGD P15428 1/20 0.45
KMT2A Q03164 1/20 0.45
TLR9 Q9NR96 2/20 0.44
TLR8 Q9NR97 2/20 0.44
TLR7 Q9NYK1 2/20 0.44
TGFBR1 P36897 3/20 0.43
ACVR1 Q04771 3/20 0.43
KCNH2 Q12809 1/20 0.43
ALK Q9UM73 3/20 0.41
FYN P06241 1/20 0.40
KDM5B Q9UGL1 1/20 0.40
TNKS O95271 2/20 0.40
PARP1 P09874 2/20 0.40
TNKS2 Q9H2K2 2/20 0.40
HRH3 Q9Y5N1 1/20 0.40

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
SCHEMBL375638 0.88 KDM4E (0.46) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL377887 0.87 KDM4E (0.47) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL10237910 0.87 KDM4E (0.47) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL377737 0.84 PDE7A (0.48) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL31115538 0.84 PDE7A (0.48) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL378038 0.82 BRD4 (0.55) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL30052318 0.82 BRD4 (0.55) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL377901 0.77 FGFR1 (0.39) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL378476 0.76 TNKS (0.62) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL15709319 0.74 BRD4 (0.52) KDM4EALDH1A1MAPTPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160137613-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2016-05-19 US disclosed
US-20160137613-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2016-05-19 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-20160137613-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 KDM4E 3726/4885ALDH1A1 650/4885MAPT 2027/4885

“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.