SCHEMBL21958108

SCHEMBL21958108

C=CC(=O)N1C[C@@H](Nc2cccc(C(F)(F)F)c2)[C@H](c2cccnc2)C1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SLC6A9 P48067 3/20 0.56
▸ EGFR P00533 3/20 0.53
▸ TEAD1 P28347 3/20 0.46
▸ BTK Q06187 4/20 0.46
▸ KMT2A Q03164 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ NAMPT P43490 1/20 0.45
▸ KIF11 P52732 1/20 0.43
▸ DCUN1D1 Q96GG9 1/20 0.43
▸ PHGDH O43175 1/20 0.41
▸ GRIN2B Q13224 1/20 0.41

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
SCHEMBL24781284 0.88 SLC6A9 (0.52) SLC6A9EGFRTEAD1BTKKMT2A
SCHEMBL24780804 0.83 TEAD1 (0.48) SLC6A9EGFRTEAD1BTKDCUN1D1
SCHEMBL23592000 0.83 TEAD1 (0.48) SLC6A9EGFRTEAD1BTKDCUN1D1
SCHEMBL21958811 0.81 SLC6A9 (0.46) SLC6A9EGFRTEAD1BTKDCUN1D1
SCHEMBL21958167 0.80 TEAD1 (0.54) EGFRTEAD1BTKKMT2AMEN1
SCHEMBL21958780 0.78 TEAD1 (0.50) EGFRTEAD1BTKKMT2AMEN1
SCHEMBL21958713 0.77 EGFR (0.66) EGFRTEAD1BTKKMT2ADCUN1D1
SCHEMBL21958800 0.77 SLC6A9 (0.42) SLC6A9EGFRTEAD1BTKDCUN1D1
SCHEMBL21958241 0.75 TEAD1 (0.50) EGFRTEAD1BTKDCUN1D1GRIN2B
SCHEMBL21958238 0.74 DCUN1D1 (0.53) EGFRTEAD1KMT2AMEN1DCUN1D1

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 4 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-2021133896-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-07-01 — — WO 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 SLC6A9 1179/4885EGFR 3966/4885TEAD1 1/4885
US-20220402869-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 SLC6A9 1701/4885EGFR 2755/4885TEAD1 1/4885

“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.

Send feedback