SCHEMBL20529258

SCHEMBL20529258

CCn1c(=O)[nH]c2ccc(C(=O)OC)cc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.55
MEN1 O00255 4/20 0.55
KDM4E B2RXH2 8/20 0.54
ALDH1A1 P00352 7/20 0.54
GAA P10253 5/20 0.54
HPGD P15428 4/20 0.54
HSD17B10 Q99714 4/20 0.54
GLA P06280 2/20 0.54
HTT P42858 2/20 0.54
PKM P14618 1/20 0.54
B3GNT2 Q9NY97 1/20 0.53
CYP1A2 P05177 2/20 0.51
PGR P06401 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
TSHR P16473 1/20 0.49
NFKB1 P19838 1/20 0.49
BLM P54132 1/20 0.49

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
SCHEMBL20529030 0.85 B3GNT2 (0.74) KMT2AMEN1KDM4EALDH1A1GAA
SCHEMBL20529229 0.84 KDM4E (0.50) KMT2AMEN1KDM4EALDH1A1GAA
SCHEMBL21839442 0.84 B3GNT2 (0.72) KMT2AMEN1KDM4EALDH1A1GAA
SCHEMBL30581078 0.84 KMT2A (0.56) KMT2AMEN1KDM4EALDH1A1GAA
SCHEMBL11976939 0.81 KDM4E (0.47) KMT2AMEN1KDM4EALDH1A1GAA
SCHEMBL1759187 0.81 CREBBP (0.51) KMT2AMEN1KDM4EALDH1A1GAA
SCHEMBL30414309 0.81 KMT2A (0.77) KMT2AMEN1KDM4EALDH1A1GAA
SCHEMBL6306378 0.81 KMT2A (0.77) KMT2AMEN1KDM4EALDH1A1GAA
SCHEMBL25734402 0.81 HTR7 (0.51) KMT2AMEN1KDM4EALDH1A1GAA
SCHEMBL27202753 0.79 KMT2A (0.70) KMT2AMEN1KDM4EALDH1A1GAA

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 KMT2A 2797/4885MEN1 376/4885KDM4E 1436/4885

“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.