SCHEMBL20529019

SCHEMBL20529019

CC1NC(=O)c2ccc(C=O)cc21

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 3/20 0.44
MKNK1 Q9BUB5 3/20 0.44
ALDH1A1 P00352 6/20 0.35
TRIM24 O15164 1/20 0.35
HPGD P15428 1/20 0.35
ALDH5A1 P51649 1/20 0.35
ABAT P80404 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TRIM33 Q9UPN9 1/20 0.35
TSHR P16473 1/20 0.34
CYP1A2 P05177 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PTGS2 P35354 1/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A3 P47895 2/20 0.33
CYP2A6 P11509 3/20 0.33
AOX1 Q06278 1/20 0.32
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL28387305 0.77 ALDH1A1 (0.47) MKNK2MKNK1ALDH1A1HPGDCYP1A2
SCHEMBL29978011 0.77 ALDH1A1 (0.47) MKNK2MKNK1ALDH1A1HPGDCYP1A2
SCHEMBL25317459 0.77 MKNK2 (0.47) MKNK2MKNK1ALDH1A1HPGDTDP1
SCHEMBL20529362 0.75 MKNK2 (0.46) MKNK2MKNK1
SCHEMBL14991575 0.75 MKNK2 (0.46) MKNK2MKNK1
SCHEMBL18786964 0.75 MKNK2 (0.46) MKNK2MKNK1
SCHEMBL25914560 0.72 MKNK2 (0.44) MKNK2MKNK1ALDH1A1CYP1A2KDM4E
SCHEMBL18467671 0.71 ALDH1A1 (0.36) ALDH1A1TRIM24HPGDALDH5A1ABAT
SCHEMBL1708832 0.70 TNKS2 (0.49) MKNK2MKNK1ALDH1A1HPGDTSHR
SCHEMBL19573959 0.70 TNKS2 (0.49) MKNK2MKNK1ALDH1A1HPGDTSHR

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
EP-3606921-B1 NEW COMPOUNDS INHIBITORS OF THE YAP/TAZ-TEAD INTERACTION AND THEIR USE IN THE TREATMENT OF MALIGNANT MESOTHELIOMA. INVENTIVA (FR) 2022-06-01 EP disclosed
US-20200115353-A1 NEW COMPOUNDS INHIBITORS OF THE YAP/TAZ-TEAD INTERACTION AND THEIR USE IN THE TREATMENT OF MALIGNANT MESOTHELIOMA INVENTIVA (FR) 2020-04-16 US disclosed
EP-3606921-A1 NEW COMPOUNDS INHIBITORS OF THE YAP/TAZ-TEAD INTERACTION AND THEIR USE IN THE TREATMENT OF MALIGNANT MESOTHELIOMA. Inventiva (FR) 2020-02-12 EP disclosed
CN-110709396-A Novel compound inhibitors of the YAP/TAZ-TEAD interaction and their use in the treatment of malignant mesothelioma 伊文蒂瓦公司 2020-01-17 CN disclosed
WO-2018185266-A1 NEW COMPOUNDS INHIBITORS OF THE YAP/TAZ-TEAD INTERACTION AND THEIR USE IN THE TREATMENT OF MALIGNANT MESOTHELIOMA. INVENTIVA (FR) 2018-10-11 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-20200115353-A1 NEW COMPOUNDS INHIBITORS OF THE YAP/TAZ-TEAD INTERACTION AND THEIR USE IN THE TREATMENT OF MALIGNANT MESOTHELIOMA YAP1, TEAD2, TEAD1 MKNK2 317/4885MKNK1 294/4885ALDH1A1 3397/4885

“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.