SCHEMBL21958740

SCHEMBL21958740

C=CC(=O)N1CCC[C@@H](Oc2cccc(C(F)(F)F)c2)C1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 4/20 0.53
BTK Q06187 5/20 0.51
EGFR P00533 5/20 0.49
ITK Q08881 2/20 0.49
EPHX2 P34913 1/20 0.49
TP53 P04637 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46
MGLL Q99685 1/20 0.45
ABHD6 Q9BV23 1/20 0.45
PARP14 Q460N5 1/20 0.45

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
SCHEMBL21958728 0.94 TEAD1 (0.59) TEAD1BTKEGFREPHX2TP53
SCHEMBL21958727 0.94 TEAD1 (0.59) TEAD1BTKEGFREPHX2TP53
SCHEMBL25785238 0.91 BTK (0.49) TEAD1BTKEGFRITKEPHX2
SCHEMBL21959041 0.83 EPHX2 (0.47) EPHX2TP53MEN1KMT2ASLC6A2
SCHEMBL21957473 0.83 EPHX2 (0.47) EPHX2TP53MEN1KMT2ASLC6A2
SCHEMBL30028494 0.82 USP30 (0.52) EPHX2TP53MEN1KMT2ASLC6A2
SCHEMBL10607268 0.81 EPHX2 (0.59) BTKEPHX2TP53MEN1KMT2A
SCHEMBL12184249 0.81 EPHX2 (0.56) EPHX2TP53MEN1KMT2ASLC6A2
SCHEMBL9596860 0.79 ABHD6 (0.50) EPHX2TP53MEN1KMT2ASLC6A2
SCHEMBL9596614 0.79 ABHD6 (0.50) EPHX2TP53MEN1KMT2ASLC6A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-06-22 US disclosed
US-20220402869-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-12-22 US disclosed
WO-2020081572-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-04-23 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 (2 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-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 TEAD1 1/4885BTK 4883/4885EGFR 3966/4885
US-20220402869-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 TEAD1 1/4885BTK 4874/4885EGFR 2755/4885

“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.