SCHEMBL5201432

SCHEMBL5201432

Cc1ccc(NC(=O)c2cc(C)ccc2NC(=O)c2ccc(N3CCCNCC3)cn2)nc1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.55
HDAC2 Q92769 3/20 0.47
HDAC3 O15379 2/20 0.47
KCNH2 Q12809 2/20 0.47
HDAC1 Q13547 2/20 0.45
CDK4 P11802 1/20 0.42
CCND1 P24385 1/20 0.42
CDK6 Q00534 1/20 0.42

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
SCHEMBL5201641 0.94 F10 (0.63) F10KCNH2
SCHEMBL5205309 0.94 F10 (0.63) F10
SCHEMBL5399453 0.90 F10 (0.62) F10
SCHEMBL5239546 0.89 F10 (0.51) F10HDAC2HDAC3HDAC1
Hydrochloric Acid SCHEMBL5395554 0.89 F10 (0.60) F10
SCHEMBL5205120 0.88 BPTF (0.51) F10
SCHEMBL5204199 0.86 F10 (0.71) F10KCNH2
SCHEMBL5205121 0.86 F10 (0.64) F10HDAC2HDAC3KCNH2
SCHEMBL5205659 0.86 HDAC3 (0.56) F10HDAC2HDAC3KCNH2HDAC1
SCHEMBL6947943 0.84 F10 (0.53) 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 11/4885HDAC2 256/4885HDAC3 149/4885

“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.