SCHEMBL4498542

SCHEMBL4498542

CC(C)(C)OC(=O)NC1CC(C(=O)N(Cc2ccccc2Cl)C2CC2)CN(C(=O)OCC2c3ccccc3-c3ccccc32)C1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.53
KMT2A Q03164 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
DRD2 P14416 3/20 0.35
F10 P00742 2/20 0.35
TLR2 O60603 1/20 0.34
TLR1 Q15399 1/20 0.34
DRD3 P35462 1/20 0.34
PGR P06401 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
ACLY P53396 1/20 0.33
MEN1 O00255 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33

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
SCHEMBL4498547 1.00 REN (0.53) RENKMT2AL3MBTL1KEAP1NFE2L2
SCHEMBL4495397 0.95 REN (0.61) RENKMT2AL3MBTL1KEAP1NFE2L2
SCHEMBL4495393 0.95 REN (0.61) RENKMT2AL3MBTL1KEAP1NFE2L2
SCHEMBL4505814 0.84 FABP7 (0.38) RENKMT2AF10PGRCYP2D6
SCHEMBL4505812 0.84 FABP7 (0.38) RENKMT2AF10PGRCYP2D6
SCHEMBL4506766 0.83 REN (0.52) REN
SCHEMBL4506775 0.83 REN (0.52) REN
SCHEMBL14428332 0.82 KMT2A (0.44) KMT2AL3MBTL1DRD2F10TLR2
SCHEMBL1913212 0.81 KMT2A (0.43) KMT2AL3MBTL1F10TLR2TLR1
SCHEMBL1913192 0.81 KMT2A (0.43) KMT2AL3MBTL1F10TLR2TLR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233920-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-09-17 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-20090233920-A1 ORGANIC COMPOUNDS REN, ACE, AGTR1 REN 1/4885KMT2A 3192/4885L3MBTL1 3191/4885

“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.