SCHEMBL3428639

SCHEMBL3428639

Cc1cc(NC(=O)C2(NC(=O)c3ccc(Cl)s3)CC3CCC2C3)ccc1C(=O)N1CCCNC(=O)C1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.47
MAPK14 Q16539 2/20 0.35
KDM4E B2RXH2 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
PDE7A Q13946 1/20 0.31
GFER P55789 1/20 0.31
GSPT1 P15170 1/20 0.31
DDB1 Q16531 1/20 0.31
CRBN Q96SW2 1/20 0.31
AVPR2 P30518 1/20 0.30
AVPR1A P37288 1/20 0.30
CCNK O75909 1/20 0.30
CDK12 Q9NYV4 1/20 0.30

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
SCHEMBL3427642 0.80 F10 (0.49) F10MAPK14KDM4ENPSR1RXFP1
SCHEMBL3428467 0.77 F10 (0.78) F10MAPK14KDM4ENPSR1RXFP1
SCHEMBL6454350 0.77 F10 (0.39) F10KDM4ENPSR1RXFP1ALDH1A1
SCHEMBL3426030 0.77 F10 (0.45) F10MAPK14KDM4ENPSR1RXFP1
SCHEMBL3428572 0.76 F10 (0.47) F10MAPK14KDM4ENPSR1RXFP1
SCHEMBL4461143 0.75 F10 (0.61) F10
SCHEMBL3426569 0.72 F10 (0.75) F10MAPK14KDM4ENPSR1RXFP1
SCHEMBL3425883 0.72 F10 (0.39) F10MAPK14NPSR1RAB9APDE7A
SCHEMBL3428575 0.69 F10 (0.48) F10MAPK14
SCHEMBL2788151 0.69 HPGD (0.40) F10KDM4ENPSR1RXFP1ALDH1A1

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 1901/4885MAPK14 3431/4885KDM4E 2298/4885

“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.