SCHEMBL4563703

SCHEMBL4563703

O=C1C=CC=C(C2=CN(CCN3CCC(c4ccccc4C(=O)NCCc4cc(F)cc(F)c4)CC3)C=CO2)C1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BCL3 P20749 5/20 0.36
CCR3 P51677 2/20 0.33
KMT2A Q03164 1/20 0.33
UTS2R Q9UKP6 2/20 0.33
ALDH1A1 P00352 2/20 0.32
NPC1 O15118 2/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
ADRA1D P25100 2/20 0.32
ADRA1A P35348 2/20 0.32
ADRA1B P35368 2/20 0.32
RAB9A P51151 1/20 0.32
DRD2 P14416 1/20 0.31
HTR2A P28223 1/20 0.31
DRD3 P35462 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
SCHEMBL4888481 0.94 CCR3 (0.40) BCL3CCR3KMT2AALDH1A1NPC1
SCHEMBL4438694 0.92 ADRA1A (0.36) BCL3CCR3UTS2RALDH1A1NPC1
SCHEMBL4432781 0.92 NPFFR1 (0.36) CCR3KMT2AUTS2RALDH1A1NPC1
SCHEMBL4553861 0.90 BCL3 (0.36) BCL3CCR3KMT2AUTS2RALDH1A1
SCHEMBL4428003 0.90 DRD3 (0.36) BCL3UTS2RALDH1A1LMNAHTT
SCHEMBL4430196 0.89 DRD4 (0.36) CCR3UTS2R
SCHEMBL4432573 0.89 TNKS (0.38) UTS2RLMNADRD2HTR2ADRD3
SCHEMBL4888759 0.89 ALDH1A1 (0.39) UTS2RALDH1A1RAB9A
SCHEMBL4433331 0.89 TNKS (0.39) CCR3KMT2AUTS2RDRD3
SCHEMBL4431351 0.89 CCR2 (0.41) CCR3KMT2AUTS2R

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
US-20080039454-A1 Urotensin II receptor antagonists JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-14 US claimed
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 disclosed
EP-2049120-A1 UROTENSIN II RECEPTOR ANTAGONISTS Janssen Pharmaceutica, N.V. (BE) 2009-04-22 EP disclosed
US-20080039454-A1 Urotensin II receptor antagonists JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-14 US 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 BCL3 4860/4885CCR3 1077/4885KMT2A 3204/4885

“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.