SCHEMBL4433449

SCHEMBL4433449

O=C1C=CC=C(C2=CN(CCN3CCC(c4ccccc4C(=O)NCC4CCCCC4)CC3)C=CO2)C1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 7/20 0.41
HTR4 Q13639 5/20 0.35
P2RX7 Q99572 1/20 0.35
NPC1 O15118 1/20 0.35
HTR7 P34969 3/20 0.34
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
KMT2A Q03164 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
SCHEMBL4438087 0.96 UTS2R (0.43) UTS2RHTR4HTR7
SCHEMBL4885280 0.90 STAT3 (0.37) UTS2RHDAC3HDAC1KMT2A
SCHEMBL4890309 0.89 BCL3 (0.35) UTS2RHDAC3HDAC1KMT2A
SCHEMBL4880934 0.88 UTS2R (0.38) UTS2RHTR7KMT2A
SCHEMBL4440078 0.88 UTS2R (0.36) UTS2RHDAC3HDAC1
SCHEMBL4427696 0.87 UTS2R (0.59) UTS2R
SCHEMBL4433580 0.87 HDAC3 (0.36) UTS2RHDAC3HDAC1KMT2A
SCHEMBL4891155 0.87 UTS2R (0.36) UTS2RHDAC3HDAC1KMT2A
SCHEMBL4430408 0.86 UTS2R (0.37) UTS2RHDAC3HDAC1
SCHEMBL4432781 0.86 NPFFR1 (0.36) UTS2RNPC1KMT2A

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 6 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
EP-2049120-A1 UROTENSIN II RECEPTOR ANTAGONISTS Janssen Pharmaceutica, N.V. (BE) 2009-04-22 EP claimed
US-20080039454-A1 Urotensin II receptor antagonists JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-14 US claimed
WO-2008016534-A1 UROTENSIN II RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-07 WO claimed
EP-2049120-A1 UROTENSIN II RECEPTOR ANTAGONISTS Janssen Pharmaceutica, N.V. (BE) 2009-04-22 EP disclosed
WO-2008016534-A1 UROTENSIN II RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-07 WO 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-20080039454-A1 Urotensin II receptor antagonists UTS2R, PLAUR, NTSR2 UTS2R 1/4885HTR4 709/4885P2RX7 486/4885

“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.