SCHEMBL4459632

SCHEMBL4459632

CC(C)(NC(=O)c1ccc(Br)s1)C(=O)Nc1ccc(N2CCOCCC2=O)c(Cl)c1

nearest known ligand 0.86

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F10 P00742 13/20 0.86
AR P10275 2/20 0.57
HTT P42858 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.39

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
SCHEMBL4460992 0.92 F10 (1.00) F10AR
SCHEMBL4462935 0.91 F10 (0.71) F10ARHTT
SCHEMBL6462937 0.89 F10 (0.78) F10ARHTTMEN1KMT2A
SCHEMBL5512209 0.87 F10 (0.66) F10ARHTTMEN1KMT2A
SCHEMBL4468098 0.87 F10 (0.70) F10ARHTTMEN1KMT2A
SCHEMBL13965131 0.87 F10 (0.70) F10ARHTTMEN1KMT2A
SCHEMBL4477814 0.85 F10 (0.75) F10ARMEN1KMT2ANPC1
SCHEMBL4460040 0.84 F10 (0.85) F10AR
SCHEMBL4468636 0.84 F10 (0.84) F10AR
SCHEMBL4005062 0.83 F10 (0.83) F10AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7476663-B2 Substituted thiophene carboxamides BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-01-13 US disclosed
US-20050277628-A1 Substituted thiophene carboxamides BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-12-15 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-20050277628-A1 Substituted thiophene carboxamides OTC, SLC22A8, DDC F10 2132/4885AR 2088/4885HTT 2031/4885

“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.