SCHEMBL4465652

SCHEMBL4465652

C/N=C1/COCCN1c1ccc(NC(=O)C2(NC(=O)c3ccc(Br)s3)CCN(C)C2)cc1C

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.43
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HTT P42858 1/20 0.35
NPC1 O15118 1/20 0.35
NFKB1 P19838 1/20 0.35
RAB9A P51151 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL4465653 1.00 F10 (0.43) F10MEN1KMT2AL3MBTL1HTT
SCHEMBL4461980 0.91 F10 (0.41) F10MEN1KMT2AL3MBTL1HTT
SCHEMBL4479359 0.91 F10 (0.45) F10MEN1KMT2AHTTNPC1
SCHEMBL4459694 0.91 F10 (0.45) F10MEN1KMT2AHTTNPC1
SCHEMBL4459695 0.91 F10 (0.45) F10MEN1KMT2AHTTNPC1
SCHEMBL4479363 0.91 F10 (0.45) F10MEN1KMT2AHTTNPC1
SCHEMBL4478194 0.90 F10 (0.45) F10MEN1KMT2AL3MBTL1HTT
SCHEMBL4463489 0.90 F10 (0.54) F10
SCHEMBL4467997 0.89 F10 (0.44) F10MEN1KMT2AHTTNPC1
SCHEMBL4467994 0.89 F10 (0.44) F10MEN1KMT2AHTTNPC1

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 2132/4885MEN1 2017/4885KMT2A 1712/4885

“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.