SCHEMBL3424035

SCHEMBL3424035

COC(=O)c1ccc(NC(=O)C(C)(C)NC(=O)c2ccc(Br)s2)cc1C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.61
F10 P00742 4/20 0.55
KMT2A Q03164 7/20 0.44
MEN1 O00255 6/20 0.44
NPSR1 Q6W5P4 2/20 0.44
MAPT P10636 2/20 0.44
NPC1 O15118 5/20 0.43
RAB9A P51151 5/20 0.43
CASP3 P42574 3/20 0.43
SENP7 Q9BQF6 3/20 0.43
PPARG P37231 1/20 0.42
NCOA1 Q15788 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42
NFKB1 P19838 3/20 0.41
NFKB2 Q00653 3/20 0.41
RELA Q04206 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
SENP8 Q96LD8 2/20 0.41
SENP6 Q9GZR1 2/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL3425293 0.89 AR (0.64) ARF10KMT2AMEN1NPSR1
SCHEMBL3425441 0.83 F10 (0.79) ARF10KMT2AMEN1NPSR1
SCHEMBL3426266 0.83 F10 (0.65) ARF10KMT2AMEN1NPSR1
SCHEMBL3426271 0.82 F10 (0.78) ARF10KMT2AMEN1NPSR1
SCHEMBL3433523 0.81 F10 (0.68) ARF10KMT2AMEN1NPSR1
SCHEMBL3423157 0.81 F10 (0.68) ARF10KMT2AMEN1NPSR1
SCHEMBL8283882 0.81 F10 (0.67) ARF10KMT2AMEN1NPSR1
SCHEMBL3426847 0.81 F10 (0.67) ARF10KMT2AMEN1NPSR1
SCHEMBL3428582 0.80 F10 (0.64) ARF10KMT2AMEN1NPSR1
SCHEMBL3428544 0.79 F10 (0.65) ARF10KMT2AMEN1NPSR1

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-7732466-B2 Substituted thiophene carboxamides, process for their preparation and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-06-08 US disclosed
US-20060293300-A1 New substituted thiophene carboxamides, process for their preparation and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-12-28 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-20060293300-A1 New substituted thiophene carboxamides, process for their preparation and their use as medicaments OTC, TPMT, ABCG2 AR 3491/4885F10 1901/4885KMT2A 2674/4885

“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.