SCHEMBL4882283

SCHEMBL4882283

COc1cccc(CCNC(=O)c2ccccc2C2CCN(CCN3C=COC(C4=CC=CC(=O)C4)=C3)CC2)c1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
DRD4 P21917 2/20 0.37
SLC5A7 Q9GZV3 1/20 0.37
THRB P10828 1/20 0.36
HTR2A P28223 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
CHRM4 P08173 2/20 0.35
SIGMAR1 Q99720 1/20 0.35

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
SCHEMBL4428003 0.95 DRD3 (0.36) SLC5A7SIGMAR1
SCHEMBL4881598 0.93 SMN1; SMN2 (0.40) THRB
SCHEMBL4437192 0.91 CRHBP (0.42) CYP2C9CYP2C19
SCHEMBL4432781 0.90 NPFFR1 (0.36) CCR3NPC1RAB9ADRD4SLC5A7
SCHEMBL4430196 0.89 DRD4 (0.36) CCR3DRD4CYP2C19
SCHEMBL4438694 0.88 ADRA1A (0.36) CCR3NPC1CHRM4SIGMAR1
SCHEMBL4430408 0.87 UTS2R (0.37) HTR2A
SCHEMBL4890066 0.87 BCL3 (0.38) NPC1RAB9ADRD4
SCHEMBL4431351 0.87 CCR2 (0.41) CCR3
SCHEMBL4563703 0.87 BCL3 (0.36) CCR3NPC1RAB9AHTR2A

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 4 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-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 CCR3 1077/4885NPC1 1911/4885RAB9A 3083/4885

“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.