SCHEMBL25789977

SCHEMBL25789977

CNS(=O)(=O)c1ccc(Nc2ccc(C(C)(F)P)cc2)c(-c2nnn(C)n2)c1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 2/20 0.55
▸ YAP1 P46937 1/20 0.55
▸ ALDH3A1 P30838 3/20 0.41
▸ TNNI3K Q59H18 10/20 0.38
▸ CCR9 P51686 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 1/20 0.33
▸ ACLY P53396 1/20 0.33

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
SCHEMBL29901822 0.92 TEAD1 (0.64) TEAD1YAP1ALDH3A1TNNI3KCCR9
SCHEMBL20766874 0.92 TEAD1 (0.64) TEAD1YAP1ALDH3A1TNNI3KCCR9
SCHEMBL20766875 0.88 ALDH3A1 (0.54) TEAD1YAP1ALDH3A1TNNI3KALDH1A1
SCHEMBL20766297 0.85 TEAD1 (0.49) TEAD1YAP1ALDH3A1TNNI3KCCR9
SCHEMBL29901827 0.85 TEAD1 (0.49) TEAD1YAP1ALDH3A1TNNI3KCCR9
SCHEMBL25789954 0.85 TEAD1 (0.46) TEAD1YAP1ALDH3A1TNNI3KMAPT
SCHEMBL20766627 0.84 TEAD1 (0.46) TEAD1YAP1ALDH3A1TNNI3KALDH1A1
SCHEMBL29901830 0.84 TEAD1 (0.46) TEAD1YAP1ALDH3A1TNNI3KALDH1A1
SCHEMBL25790329 0.84 TEAD1 (0.41) TEAD1YAP1CCR9ALDH1A1MAPT
SCHEMBL29901803 0.84 TEAD1 (0.52) TEAD1YAP1TNNI3KCCR9ALDH1A1

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 1 patent. 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

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-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 TEAD1 1/4885YAP1 9/4885ALDH3A1 1939/4885

“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.

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