SCHEMBL5557359

SCHEMBL5557359

CCOC(=O)c1cccc(Nc2nnc(-c3cccc(Oc4cccc(C(F)(F)F)c4)c3)s2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 5/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
ALDH1A1 P00352 3/20 0.48
HPGD P15428 3/20 0.48
HSD17B10 Q99714 2/20 0.48
USP2 O75604 1/20 0.48
SYK P43405 1/20 0.47
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
DHODH Q02127 1/20 0.44
TP53 P04637 5/20 0.44
LMNA P02545 1/20 0.44
THRB P10828 1/20 0.44
HTT P42858 1/20 0.44
CDC25B P30305 3/20 0.42
CDC25A P30304 1/20 0.42
CDC25C P30307 1/20 0.42

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
SCHEMBL5556610 0.89 AKR1C3 (0.44) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL5556608 0.88 ROCK2 (0.50) MAPTKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL5556656 0.85 PARP10 (0.53) KMT2AALDH1A1SYKTHRB
SCHEMBL6153554 0.83 AKR1C3 (0.47) MAPTMEN1KMT2AKDM4ENPSR1
SCHEMBL6154121 0.82 ROCK1 (0.46) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL6154124 0.82 ROCK1 (0.46) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL6154296 0.80 CFTR (0.43) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL6154291 0.80 CFTR (0.43) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL6154361 0.79 KDM4E (0.60) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL6153748 0.77 GUSB (0.54) MAPTMEN1KMT2AALDH1A1NPSR1

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-20070197577-A1 Inhibitors of anthrax lethal factor CENGENT THERAPEUTICS (US) 2007-08-23 US disclosed
WO-2005027856-A2 INHIBITORS OF ANTHRAX LETHAL FACTOR CENGENT THERAPEUTICS (US) 2005-03-31 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-20070197577-A1 Inhibitors of anthrax lethal factor APAF1, ANTXR2, LITAF MAPT 4430/4885MEN1 3362/4885KMT2A 4006/4885

“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.