SCHEMBL4094121

SCHEMBL4094121

C[C@@H](c1ccc(F)cc1)N1CC(C)(C)OC(=O)C1=O

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.48
CYP3A4 P08684 9/20 0.41
CYP2C9 P11712 6/20 0.41
CYP2C19 P33261 5/20 0.41
KCNH2 Q12809 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
SCHEMBL4330555 0.74 HSD11B1 (0.45) HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL4088740 0.74 HSD11B1 (0.48) HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL4333631 0.74 OPRM1 (0.36) HSD11B1KCNH2
SCHEMBL4092929 0.70 HSD11B1 (0.49) HSD11B1CYP3A4CYP2C9CYP2C19KCNH2
SCHEMBL4082787 0.67 HSD11B1 (0.44) HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL8023232 0.66 PSEN1 (0.49) HSD11B1CYP3A4CYP2C9CYP2C19KCNH2
SCHEMBL9986125 0.65 HSD11B1 (1.00) HSD11B1
SCHEMBL1239609 0.65 HSD11B1 (0.47) HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL958458 0.64 HSD11B1 (0.67) HSD11B1CYP3A4CYP2C9CYP2C19KCNH2
SCHEMBL8021550 0.64 PSEN1 (0.47) HSD11B1CYP3A4CYP2C9CYP2C19KCNH2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7618960-B2 Morpholine type cinnamide compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-11-17 US disclosed
US-20090203697-A1 HETEROCYCLIC TYPE CINNAMIDE DERIVATIVE EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-08-13 US disclosed
EP-2019094-A1 HETEROCYCLIC TYPE CINNAMIDE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2009-01-28 EP disclosed
EP-1953154-A1 MORPHOLINE TYPE CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2008-08-06 EP disclosed
US-20070117798-A1 Morpholine type cinnamide compound EISAI R&D MANAGEMENT CO., LTD. 2007-05-24 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 (2 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-20070117798-A1 Morpholine type cinnamide compound MLX, XDH, NOX4 HSD11B1 985/4885CYP3A4 56/4885CYP2C9 611/4885
US-20090203697-A1 HETEROCYCLIC TYPE CINNAMIDE DERIVATIVE CLIC4, NR3C2, MAN2B1 HSD11B1 194/4885CYP3A4 43/4885CYP2C9 469/4885

“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.