SCHEMBL4428017

SCHEMBL4428017

CC(C)(C)OC(=O)NCCCCCNC(=O)c1cc(Cl)ccc1C1CC2CCC(C1)N2CCN1C(=O)COc2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 9/20 0.64
HSD17B10 Q99714 2/20 0.41
POLB P06746 1/20 0.41
USP2 O75604 1/20 0.41
DRD2 P14416 1/20 0.40
TSHR P16473 2/20 0.39
KDM4E B2RXH2 1/20 0.38
GRM5 P41594 1/20 0.38
CHRM1 P11229 1/20 0.38

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
SCHEMBL15826894 0.92 UTS2R (0.57) UTS2RHSD17B10POLBDRD2TSHR
SCHEMBL15826895 0.92 UTS2R (0.57) UTS2RHSD17B10POLBDRD2TSHR
SCHEMBL4434320 0.92 UTS2R (0.57) UTS2RHSD17B10POLBDRD2TSHR
SCHEMBL4430402 0.90 UTS2R (0.79) UTS2RDRD2CHRM1
SCHEMBL4428005 0.90 UTS2R (0.79) UTS2RDRD2CHRM1
SCHEMBL15827161 0.89 UTS2R (0.49) UTS2RDRD2
SCHEMBL4884050 0.89 UTS2R (0.80) UTS2RDRD2CHRM1
SCHEMBL4432485 0.86 UTS2R (0.56) UTS2RHSD17B10POLBUSP2DRD2
SCHEMBL4439849 0.84 UTS2R (0.55) UTS2RHSD17B10POLBUSP2DRD2
SCHEMBL4440086 0.83 UTS2R (0.78) UTS2RKDM4ECHRM1

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 10 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
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
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 UTS2R 1/4885HSD17B10 3597/4885POLB 4040/4885

“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.