SCHEMBL5201860

SCHEMBL5201860

O=C(O)c1ccc(C(=O)Nc2ccc(Cl)cn2)c(NC(=O)c2cnc(N3CCCNCC3)cn2)c1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.56
HDAC3 O15379 4/20 0.49
HDAC2 Q92769 4/20 0.49
HDAC1 Q13547 1/20 0.47
KCNH2 Q12809 1/20 0.45

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
SCHEMBL14591670 0.94 F10 (0.62) F10KCNH2
SCHEMBL14591666 0.91 F10 (0.54) F10HDAC3HDAC2HDAC1KCNH2
SCHEMBL6953757 0.91 F10 (0.48) F10KCNH2
SCHEMBL5202321 0.91 F10 (0.59) F10KCNH2
Trifluoroacetic Acid SCHEMBL5274433 0.90 F10 (0.57) F10
SCHEMBL5204077 0.88 F10 (0.66) F10KCNH2
SCHEMBL14591667 0.87 F10 (0.55) F10HDAC3HDAC2HDAC1
SCHEMBL5205706 0.87 F10 (0.61) F10KCNH2
Hydrochloric Acid SCHEMBL5203061 0.87 F10 (0.54) F10HDAC3HDAC2HDAC1
SCHEMBL14591677 0.86 F10 (0.49) F10KCNH2

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
EP-1307444-B1 SUBSTITUTED HETEROCYCLIC AMIDES LILLY CO ELI (US) 2007-10-03 EP disclosed
US-7160878-B2 Substituted heterocyclic amides ELI LILLY AND COMPANY (US) 2007-01-09 US disclosed
US-7160878-B2 Substituted heterocyclic amides ELI LILLY AND COMPANY (US) 2007-01-09 US disclosed
US-7160878-B2 Substituted heterocyclic amides ELI LILLY AND COMPANY (US) 2007-01-09 US disclosed
US-20040097491-A1 Substituted heterocyclic amides HERRON DAVID KENT (US) 2004-05-20 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-20040097491-A1 Substituted heterocyclic amides F12, F11, F8 F10 11/4885HDAC3 149/4885HDAC2 256/4885

“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.