SCHEMBL4881586

SCHEMBL4881586

O=C1C=CC=C(C2=CN(CCN3C4C=C(c5ccc(Cl)cc5C(=O)NCCN5CCN(C(=O)O)CC5)CC3CC4)C=CO2)C1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.35
CYP2C19 P33261 1/20 0.32
PLD2 O14939 1/20 0.31
PLD1 Q13393 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
SCHEMBL4426618 0.92 UTS2R (0.45) UTS2R
SCHEMBL4438280 0.78 UTS2R (0.42) UTS2RCYP2C19
SCHEMBL4440269 0.78 UTS2R (0.41) UTS2RCYP2C19PLD2PLD1
SCHEMBL4881578 0.74 UTS2R (0.60) UTS2R
SCHEMBL4884060 0.73 UTS2R (0.46) UTS2R
SCHEMBL4439938 0.73 UTS2R (0.43) UTS2R
SCHEMBL4431353 0.72 MAPT (0.40) UTS2R
SCHEMBL4430255 0.72 UTS2R (0.38) UTS2R
SCHEMBL4440091 0.72 UTS2R (0.45) UTS2R
SCHEMBL4430180 0.72 UTS2R (0.43) UTS2R

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 2 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 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 1/4885CYP2C19 4421/4885PLD2 829/4885

“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.