SCHEMBL4843381

SCHEMBL4843381

C[C@H](N)C(=O)N(C(=O)Cc1cc(F)cc(F)c1)[C@H]1C[C@H](c2ccccc2)CCNC1=O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MASP2 O00187 5/20 0.36
SMYD3 Q9H7B4 1/20 0.34
F2 P00734 5/20 0.34
GPR88 Q9GZN0 2/20 0.33
APOL1 O14791 1/20 0.33
SIGMAR1 Q99720 2/20 0.33
SLC18A3 Q16572 1/20 0.33
MC4R P32245 1/20 0.33
CCNE1 P24864 2/20 0.32
CDK2 P24941 2/20 0.32
GSK3B P49841 2/20 0.32
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
CCR5 P51681 1/20 0.32

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
SCHEMBL4833636 1.00 MASP2 (0.36) MASP2SMYD3F2GPR88APOL1
SCHEMBL4842750 0.87 SMYD3 (0.34) MASP2SMYD3F2GPR88SIGMAR1
SCHEMBL4842540 0.87 SMYD3 (0.34) MASP2SMYD3F2GPR88SIGMAR1
SCHEMBL4839449 0.85 GPR88 (0.33) SMYD3F2GPR88SIGMAR1SLC18A3
SCHEMBL4844607 0.85 GPR88 (0.33) SMYD3F2GPR88SIGMAR1SLC18A3
SCHEMBL4841470 0.85 GPR88 (0.33) SMYD3F2GPR88SIGMAR1SLC18A3
SCHEMBL4845174 0.84 NR1I2 (0.33) MASP2GPR88APOL1
SCHEMBL4842878 0.84 NR1I2 (0.33) MASP2GPR88APOL1
SCHEMBL4840673 0.84 NR1I2 (0.33) MASP2GPR88APOL1
SCHEMBL4841664 0.84 NR1I2 (0.33) MASP2GPR88APOL1

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-7342007-B2 Lactams and uses thereof ASTRAZENECA AB (SE) 2008-03-11 US claimed
US-20060183732-A1 Novel lactams and uses thereof ASTRAZENECA AB (SE) 2006-08-17 US claimed
US-7342007-B2 Lactams and uses thereof ASTRAZENECA AB (SE) 2008-03-11 US disclosed
US-20060183732-A1 Novel lactams and uses thereof ASTRAZENECA AB (SE) 2006-08-17 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-20060183732-A1 Novel lactams and uses thereof BACE1, BACE2, APP MASP2 290/4885SMYD3 4425/4885F2 2319/4885

“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.