SCHEMBL4891155

SCHEMBL4891155

CC(=O)NCCNC(=O)c1ccccc1C1CCN(CCN2C=COC(C3=CC=CC(=O)C3)=C2)CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 3/20 0.36
DRD3 P35462 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
OPRD1 P41143 1/20 0.32
BCL3 P20749 2/20 0.32
ADRA1D P25100 1/20 0.31
ADRA1A P35348 1/20 0.31
ADRA1B P35368 1/20 0.31
PRCP P42785 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL4440078 0.93 UTS2R (0.36) UTS2RDRD3HDAC3HDAC1BCL3
SCHEMBL4430408 0.92 UTS2R (0.37) UTS2RDRD3HDAC3HDAC1BCL3
SCHEMBL4890309 0.91 BCL3 (0.35) UTS2RDRD3HDAC3HDAC1BCL3
SCHEMBL4885280 0.91 STAT3 (0.37) UTS2RDRD3HDAC3HDAC1BCL3
SCHEMBL4433580 0.91 HDAC3 (0.36) UTS2RHDAC3HDAC1BCL3ADRA1D
SCHEMBL4890241 0.90 HPGD (0.37) UTS2RDRD3HDAC3HDAC1ADRA1D
SCHEMBL4432781 0.90 NPFFR1 (0.36) UTS2ROPRD1MEN1KMT2A
SCHEMBL4438087 0.89 UTS2R (0.43) UTS2RDRD3
SCHEMBL4430165 0.89 HPGD (0.39) UTS2RDRD3HDAC3HDAC1MEN1
SCHEMBL4884906 0.89 ADAM17 (0.36) UTS2ROPRD1MEN1KMT2A

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-8759342-B2 Benzo[1,4]oxazin-3-one, benzo[1,4]thiazin-3-one and quinolin-2-one urotensin II receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2014-06-24 US claimed
US-20080039454-A1 Urotensin II receptor antagonists JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-14 US claimed

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-20080039454-A1 Urotensin II receptor antagonists UTS2R, PLAUR, NTSR2 UTS2R 1/4885DRD3 1857/4885HDAC3 4162/4885

“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.