SCHEMBL5462845

SCHEMBL5462845

Cc1cc(N[C]=O)ccc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.50
TP53 P04637 1/20 0.50
PDE10A Q9Y233 1/20 0.42
KMT2A Q03164 3/20 0.41
GAA P10253 3/20 0.41
G6PD P11413 2/20 0.41
MEN1 O00255 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HSP90AA1 P07900 2/20 0.41
HSP90AB1 P08238 1/20 0.41
ESR1 P03372 8/20 0.41
ESR2 Q92731 6/20 0.41
AR P10275 3/20 0.38
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL5457638 0.81 TOP1 (0.44) GAAL3MBTL1KDM4EMAPTALOX15
SCHEMBL5543205 0.81 POLB (0.48) TP53KMT2AGAAALDH1A1MAPT
SCHEMBL2059694 0.76 TDP1 (0.54) TDP1TP53PDE10AKMT2AGAA
SCHEMBL2093997 0.76 RAPGEF4 (0.42) KMT2AGAAMEN1ALDH1A1MAPT
SCHEMBL8350047 0.74 TP53 (0.52) TDP1TP53PDE10AKMT2AGAA
SCHEMBL4686246 0.73 HSP90AA1 (0.53) TDP1TP53PDE10AKMT2AGAA
SCHEMBL11473042 0.73 MAPT (0.38) TDP1TP53KMT2AGAAMEN1
SCHEMBL11560353 0.73 MEN1 (0.68) TDP1TP53PDE10AKMT2AGAA
SCHEMBL7352506 0.73 MEN1 (0.32) KMT2AGAAG6PDMEN1L3MBTL1
SCHEMBL15904099 0.73 CSNK2A1 (0.53) TDP1KMT2AMEN1KDM4EALDH1A1

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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2007-11-29 US disclosed
EP-1666469-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR Institute of Medicinal Molecular Design, Inc. (JP) 2006-06-07 EP 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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 TDP1 3143/4885TP53 3114/4885PDE10A 4214/4885

“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.