SCHEMBL4430264

SCHEMBL4430264

O=C1C=CC=C(C2=CN(CCN3CCC(C(=O)NCc4ccccc4)(c4ccccc4)CC3)C=CO2)C1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
OPRL1 P41146 7/20 0.42
OPRM1 P35372 2/20 0.42
ERCC1 P07992 1/20 0.35
ERCC4 Q92889 1/20 0.35
ADRA1D P25100 3/20 0.34
ADRA1A P35348 3/20 0.34
OPRD1 P41143 2/20 0.34
KCNH2 Q12809 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM3 P20309 1/20 0.34
METAP2 P50579 1/20 0.33
ADRA1B P35368 1/20 0.33

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
SCHEMBL4431744 0.88 KMT2A (0.36) ALDH1A1OPRM1OPRD1
SCHEMBL4880934 0.81 UTS2R (0.38) ALDH1A1
SCHEMBL4440061 0.75 MAPK1 (0.36) LMNATSHR
SCHEMBL4432781 0.75 NPFFR1 (0.36) ALDH1A1OPRD1LMNA
SCHEMBL1554091 0.75 CHRM1 (0.49) ADRA1AKCNH2CHRM5CHRM3ADRA1B
SCHEMBL4430180 0.75 UTS2R (0.43)
SCHEMBL15808512 0.74 EPHX2 (0.37) ALDH1A1TSHR
SCHEMBL4434641 0.74 USP2 (0.39) ALDH1A1LMNATSHR
SCHEMBL4432724 0.72 UTS2R (0.61) LMNA
SCHEMBL4428992 0.72 UTS2R (0.42) ALDH1A1LMNA

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
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

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 ALDH1A1 4139/4885OPRL1 102/4885OPRM1 557/4885

“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.