SCHEMBL4496044

SCHEMBL4496044

Cc1scc2c1c(O)c(C(=O)N(C)c1ccc(Cl)cc1)c(=O)n2C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
PGR P06401 1/20 0.49
HDAC4 P56524 1/20 0.46
GPBAR1 Q8TDU6 12/20 0.39
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
SRC P12931 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 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
SCHEMBL4504478 0.92 MEN1 (0.52) MEN1KMT2APGRHDAC4GPBAR1
SCHEMBL4510892 0.89 KMT2A (0.63) MEN1KMT2APGRHDAC4SRC
SCHEMBL4509464 0.87 HDAC4 (0.52) MEN1KMT2APGRHDAC4GPBAR1
SCHEMBL4512590 0.86 HDAC4 (0.63) MEN1KMT2APGRHDAC4GPBAR1
SCHEMBL5238949 0.83 HDAC4 (0.51) MEN1KMT2APGRHDAC4GPBAR1
SCHEMBL4511684 0.82 MEN1 (0.44) MEN1KMT2APGRHDAC4GPBAR1
SCHEMBL5166744 0.81 HDAC4 (0.57) MEN1KMT2APGRHDAC4GPBAR1
SCHEMBL5165280 0.80 HDAC4 (0.58) MEN1KMT2APGRHDAC4GPBAR1
SCHEMBL4498207 0.79 HDAC4 (0.39) MEN1KMT2APGRHDAC4NPC1
SCHEMBL5233610 0.78 MEN1 (0.42) MEN1KMT2APGRHDAC4GPBAR1

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 MEN1 509/4885KMT2A 4071/4885PGR 438/4885

“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.