SCHEMBL3429300

SCHEMBL3429300

Cc1cc(NC(=O)C2(NC(=O)c3ccc(Cl)s3)CCOC2)ccc1C(=O)N1CCN(C=O)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.51
ALDH1A1 P00352 5/20 0.35
MAPT P10636 4/20 0.35
KMT2A Q03164 4/20 0.35
HTT P42858 3/20 0.35
MEN1 O00255 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
HPGD P15428 3/20 0.35
LMNA P02545 3/20 0.35
USP2 O75604 1/20 0.35
TP53 P04637 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
PRSS12 P56730 1/20 0.35
ADRB2 P07550 1/20 0.34

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
SCHEMBL3421824 0.91 F10 (0.53) F10ALDH1A1MAPTKMT2AHTT
SCHEMBL3429455 0.91 F10 (0.40) F10ALDH1A1MAPTKMT2AHTT
SCHEMBL3428575 0.85 F10 (0.48) F10
SCHEMBL3428572 0.84 F10 (0.47) F10ALDH1A1MAPTKMT2AHTT
SCHEMBL3427642 0.83 F10 (0.49) F10ALDH1A1MAPTKMT2AHTT
SCHEMBL3425891 0.82 F10 (0.41) F10ALDH1A1MAPTKMT2AHTT
SCHEMBL3421749 0.81 F10 (0.48) F10MAPTKMT2AHTTMEN1
SCHEMBL3771943 0.81 F10 (0.48) F10MAPTKMT2AHTTMEN1
SCHEMBL3777662 0.81 F10 (0.48) F10MAPTKMT2AHTTMEN1
SCHEMBL3424315 0.81 F10 (0.45) F10ALDH1A1MAPTKMT2AHTT

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 F10 1901/4885ALDH1A1 1734/4885MAPT 1066/4885

“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.