SCHEMBL13990311

SCHEMBL13990311

C=Cc1cccc(C(C)C)c1N1C(=O)c2ccccc2C1=O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.58
NR1H3 Q13133 3/20 0.58
NR1H2 P55055 2/20 0.58
ANPEP P15144 4/20 0.52
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
CASP1 P29466 1/20 0.39
CASP3 P42574 1/20 0.39
CASP7 P55210 1/20 0.39
SENP8 Q96LD8 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
KMT2A Q03164 2/20 0.37
FAAH O00519 1/20 0.37
MGLL Q99685 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
SCHEMBL11022177 0.86 DPP4 (0.64) DPP4NR1H3NR1H2ANPEP
SCHEMBL29366407 0.84 DPP4 (0.78) DPP4NR1H3NR1H2ANPEPCASP3
SCHEMBL2820118 0.84 DPP4 (0.78) DPP4NR1H3NR1H2ANPEPCASP3
SCHEMBL14458034 0.84 ANPEP (0.49) DPP4NR1H3NR1H2ANPEPKMT2A
SCHEMBL10269051 0.83 ANPEP (0.43) DPP4NR1H3NR1H2ANPEPKDM4E
SCHEMBL12206252 0.83 ANPEP (0.45) DPP4NR1H3NR1H2ANPEPKDM4E
SCHEMBL13784709 0.81 ANPEP (0.43) DPP4NR1H3NR1H2ANPEP
SCHEMBL179197 0.80 DPP4 (0.45) DPP4NR1H3NR1H2ANPEP
SCHEMBL12066788 0.80 DPP4 (0.45) DPP4NR1H3NR1H2ANPEP
SCHEMBL12066773 0.79 ANPEP (0.44) DPP4NR1H3NR1H2ANPEP

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-20080306134-A1 THALIDOMIDE ANALOGS FOR TREATING VASCULAR ABNORMALITIES CHARLESSON, LLC 2008-12-11 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-20080306134-A1 THALIDOMIDE ANALOGS FOR TREATING VASCULAR ABNORMALITIES VEGFA, FLT1, VCAM1 DPP4 4355/4885NR1H3 4388/4885NR1H2 4128/4885

“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.