SCHEMBL3426657

SCHEMBL3426657

Cc1cc(NC(=O)C(C)(C)NC(=O)c2ccc(Cl)s2)ccc1C(=O)N1CCCC1C

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.76
AR P10275 3/20 0.54
HSD11B1 P28845 1/20 0.44
ALDH1A1 P00352 3/20 0.41
GAA P10253 1/20 0.41
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HPGD P15428 2/20 0.38
NPC1 O15118 1/20 0.38
NFKB1 P19838 1/20 0.38
RAB9A P51151 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KCNK3 O14649 1/20 0.38
AVPR2 P30518 2/20 0.38
AVPR1A P37288 2/20 0.38
ABCB11 O95342 1/20 0.38
ADRB2 P07550 1/20 0.38
HTR1A P08908 1/20 0.38

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
SCHEMBL3423978 0.97 F10 (0.77) F10ARHSD11B1ALDH1A1GAA
SCHEMBL3429634 0.90 F10 (0.73) F10ARAVPR2AVPR1AABCB11
SCHEMBL13309735 0.90 F10 (0.73) F10ARAVPR2AVPR1AABCB11
SCHEMBL3423387 0.90 F10 (0.60) F10ARHSD11B1ALDH1A1GAA
SCHEMBL3426722 0.89 F10 (0.72) F10ARAVPR2AVPR1ARORC
SCHEMBL3428529 0.89 F10 (0.72) F10ARHSD11B1RAB9AAVPR2
SCHEMBL3424110 0.89 F10 (0.72) F10ARHSD11B1RAB9AAVPR2
SCHEMBL3424472 0.89 F10 (0.72) F10ARGAAAVPR2AVPR1A
SCHEMBL3427717 0.88 F10 (0.74) F10ARHSD11B1ALDH1A1MEN1
SCHEMBL3425343 0.88 F10 (0.71) F10ARAVPR2AVPR1AABCB11

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
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-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-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
WO-2005111014-A1 SUBSTITUTED THIOPHEN-CARBOXYLIC ACID AMIDES, THE PRODUCTION AND THE USE THEREOF IN THE FORM OF A DRUG BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-24 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-20060293300-A1 New substituted thiophene carboxamides, process for their preparation and their use as medicaments OTC, TPMT, ABCG2 F10 1901/4885AR 3491/4885HSD11B1 4158/4885

“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.