SCHEMBL4887925

SCHEMBL4887925

O=C(NCCc1cccc(F)c1F)c1ccccc1C1CCN(CCN2C(=O)COc3ccccc32)CC1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 9/20 0.58
POLB P06746 1/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 2/20 0.47
CHRM1 P11229 6/20 0.45
DRD2 P14416 2/20 0.43
KCNH2 Q12809 2/20 0.43

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
SCHEMBL4553860 0.89 UTS2R (0.58) UTS2RPOLBMAPK1HTTCHRM1
SCHEMBL4434648 0.88 UTS2R (0.60) UTS2RHTTCHRM1
SCHEMBL4429014 0.87 UTS2R (0.60) UTS2RHTTCHRM1DRD2KCNH2
SCHEMBL4431490 0.86 UTS2R (0.64) UTS2RHTTCHRM1DRD2KCNH2
SCHEMBL4438689 0.86 UTS2R (0.58) UTS2RPOLBMAPK1HTTCHRM1
SCHEMBL4890054 0.86 UTS2R (0.62) UTS2RCHRM1DRD2
SCHEMBL4563701 0.86 UTS2R (0.60) UTS2RPOLBMAPK1HTTCHRM1
SCHEMBL4890303 0.84 UTS2R (0.65) UTS2RPOLBMAPK1HTTCHRM1
SCHEMBL4431814 0.84 UTS2R (0.68) UTS2RHTTCHRM1DRD2KCNH2
SCHEMBL4433328 0.84 UTS2R (0.61) UTS2RHTTCHRM1DRD2KCNH2

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 7 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
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
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
US-20080039454-A1 Urotensin II receptor antagonists JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-14 US disclosed
US-20080039454-A1 Urotensin II receptor antagonists JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-14 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-20080039454-A1 Urotensin II receptor antagonists UTS2R, PLAUR, NTSR2 UTS2R 1/4885POLB 4040/4885MAPK1 4201/4885

“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.