SCHEMBL4300577

SCHEMBL4300577

CC(=O)N1c2ccc(C(=O)NCCN3CCCCC3)cc2NC2=C(C(=O)CC(C)(C)C2)C1c1ccc(Cl)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.42
F10 P00742 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
CACNA1G O43497 4/20 0.40
RAD52 P43351 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL4297017 0.93 KMT2A (0.45) ALDH1A1KMT2AMEN1LMNAHTT
SCHEMBL4292291 0.88 KMT2A (0.42) KMT2AMEN1SMN1; SMN2
SCHEMBL4291080 0.87 KMT2A (0.40) KMT2AMEN1
SCHEMBL4287492 0.87 MEN1 (0.41) KMT2AMEN1
SCHEMBL4296392 0.86 MEN1 (0.42) KMT2AMEN1
SCHEMBL4296733 0.85 MEN1 (0.40) ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL4295874 0.85 MEN1 (0.44) KMT2AMEN1
SCHEMBL4293980 0.84 MEN1 (0.44) KMT2AMEN1
SCHEMBL4287067 0.83 MEN1 (0.48) ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL4288838 0.83 MEN1 (0.42) KMT2AMEN1

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-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS BONFANTI JEAN-FRANCOIS 2009-09-03 US disclosed
US-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS BONFANTI JEAN-FRANCOIS 2009-09-03 US disclosed
US-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS BONFANTI JEAN-FRANCOIS 2009-09-03 US disclosed
WO-2007026024-A2 BENZODIAZEPINES AS HCV INHIBITORS TIBOTEC PHARMACEUTICALS LTD. (IE) 2007-03-08 WO 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-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS GABRA5, GABRA4, GABRA3 NTRK1 3822/4885F10 3396/4885ALDH1A1 372/4885

“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.