SCHEMBL4087160

SCHEMBL4087160

C[C@@H](c1ccc(F)cc1)N1CCCC(P(=O)(O)O)C1=O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ENO1 P06733 2/20 0.46
HSD11B1 P28845 9/20 0.45
CYP3A4 P08684 2/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
OPRM1 P35372 1/20 0.36
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 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
SCHEMBL4678027 1.00 ENO1 (0.46) ENO1HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL2824898 0.92 HSD11B1 (0.46) ENO1HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL13662806 0.82 HSD11B1 (0.39) ENO1HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL8038060 0.81 HSD11B1 (0.51) HSD11B1CYP3A4CYP2C9CYP2C19OPRM1
SCHEMBL4298912 0.79 HSD11B1 (0.45) HSD11B1CYP3A4CYP2C9CYP2C19OPRM1
SCHEMBL4100291 0.79 HSD11B1 (0.45) HSD11B1CYP3A4CYP2C9CYP2C19OPRM1
SCHEMBL4294143 0.79 HSD11B1 (0.45) HSD11B1CYP3A4CYP2C9CYP2C19OPRM1
SCHEMBL4304050 0.79 HSD11B1 (0.45) HSD11B1CYP3A4CYP2C9CYP2C19OPRM1
SCHEMBL4082787 0.79 HSD11B1 (0.44) HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL4296589 0.78 HSD11B1 (0.46) HSD11B1CYP3A4CYP2C9CYP2C19PSEN1

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-20090270623-A1 PROCESS FOR PRODUCTION OF CINNAMIDE DERIVATIVE EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-10-29 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-1950211-A1 PROCESS FOR PRODUCTION OF CINNAMAMIDE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2008-07-30 EP 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-20090270623-A1 PROCESS FOR PRODUCTION OF CINNAMIDE DERIVATIVE CBR1, H1-0, CBR3 ENO1 1356/4885HSD11B1 495/4885CYP3A4 26/4885
US-20090203697-A1 HETEROCYCLIC TYPE CINNAMIDE DERIVATIVE CLIC4, NR3C2, MAN2B1 ENO1 3234/4885HSD11B1 194/4885CYP3A4 43/4885

“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.