SCHEMBL4518939

SCHEMBL4518939

Cn1c(=O)c(C(=O)O)c(O)c2cscc21

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 2/20 0.44
EGLN1 Q9GZT9 3/20 0.42
PGR P06401 1/20 0.42
KDM4E B2RXH2 4/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NLRP3 Q96P20 1/20 0.37
HIF1A Q16665 3/20 0.37
EGFR P00533 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL4509649 0.83 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL4519866 0.79 MEN1 (0.73) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL4507476 0.76 MEN1 (0.53) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL1685948 0.75 ALDH1A1 (0.77) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL2384232 0.71 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL11372872 0.71 GSK3B (0.57) ALDH1A1MEN1KMT2APGRHIF1A
SCHEMBL11373100 0.71 MEN1 (0.50) ALDH1A1MEN1KMT2AEGLN1KDM4E
SCHEMBL4508104 0.71 MEN1 (0.45) ALDH1A1MEN1KMT2AEGLN1PGR
SCHEMBL3634507 0.70 EGLN1 (0.67) EGLN1
SCHEMBL11404065 0.69 HIF1A (0.54) ALDH1A1MEN1KMT2ARAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7553849-B2 Compounds ACTIVE BIOTECH AB (SE) 2009-06-30 US disclosed
EP-1776369-B1 THIENOPYRIDONE CARBOXAMIDES AND THEIR MEDICAL USE ACTIVE BIOTECH AB (SE) 2007-10-10 EP disclosed
US-20060004038-A1 Novel compounds ACTIVE BIOTECH AB (SE) 2006-01-05 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-20060004038-A1 Novel compounds REL, CLIC4, C5 ALDH1A1 3955/4885MEN1 509/4885KMT2A 4071/4885

“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.