SCHEMBL22669409

SCHEMBL22669409

O=C(COc1ccc(Cl)cc1)NCC[C@H](O)CNC(=O)COc1ccc(F)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
TP53 P04637 3/20 0.47
THRB P10828 1/20 0.47
KDM4E B2RXH2 1/20 0.46
ADAMTS5 Q9UNA0 1/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GAA P10253 1/20 0.45
ALOX12 P18054 1/20 0.45
MAPT P10636 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
HTT P42858 1/20 0.44
ATF4 P18848 3/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL20999707 0.94 HTT (0.47) LMNAKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL22669244 0.94 HTT (0.47) LMNAKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL20999107 0.93 ATF4 (0.51) LMNATP53THRBKDM4EADAMTS5
SCHEMBL22669148 0.93 ATF4 (0.51) LMNATP53THRBKDM4EADAMTS5
SCHEMBL20999704 0.93 ATF4 (0.51) LMNATP53THRBKDM4EADAMTS5
SCHEMBL20999239 0.92 ATF4 (0.52) MEN1KMT2AHTTATF4ALDH1A1
SCHEMBL20999090 0.92 PRMT5 (0.48) LMNATP53THRBKDM4EMEN1
SCHEMBL22669325 0.92 PRMT5 (0.48) LMNATP53THRBKDM4EMEN1
SCHEMBL22669692 0.92 PRMT5 (0.48) LMNATP53THRBKDM4EMEN1
SCHEMBL20999782 0.91 KDM4E (0.54) TP53KDM4EADAMTS5MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2020-11-19 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-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 LMNA 3376/4885TP53 3361/4885THRB 1462/4885

“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.