SCHEMBL25786909

SCHEMBL25786909

Cc1nn(CCO)cc1-c1ccccc1Nc1ccc(C(C)(F)P)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.36
▸ ABL1 P00519 1/20 0.35
▸ BCR P11274 1/20 0.35
▸ EED O75530 1/20 0.35
▸ SUZ12 Q15022 1/20 0.35
▸ EZH2 Q15910 1/20 0.35
▸ BRAF P15056 1/20 0.34
▸ PDK2 Q15119 5/20 0.32
▸ PDK1 Q15118 1/20 0.32
▸ PDK3 Q15120 1/20 0.32
▸ TMEM97 Q5BJF2 1/20 0.32
▸ SIGMAR1 Q99720 1/20 0.32
▸ DHODH Q02127 1/20 0.32
▸ JAK2 O60674 3/20 0.32
▸ JAK3 P52333 3/20 0.32
▸ PTK2 Q05397 3/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TAS2R14 Q9NYV8 1/20 0.31
▸ BCDIN3D Q7Z5W3 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
SCHEMBL20552661 0.91 BRAF (0.42) GAAABL1BCRBRAFDHODH
SCHEMBL25786915 0.82 ABL1 (0.37) GAAABL1BCREEDSUZ12
SCHEMBL20552230 0.82 ALDH1A1 (0.45) GAADHODHKMT2ABCDIN3DALDH1A1
SCHEMBL25786853 0.76 MEN1 (0.39) GAADHODHJAK2MEN1KMT2A
SCHEMBL25786824 0.75 GAA (0.38) GAAABL1BCREEDSUZ12
SCHEMBL20551922 0.74 TRPM2 (0.41) BRAFDHODHJAK2MEN1KMT2A
SCHEMBL20553542 0.74 BRAF (0.41) GAABRAFDHODHJAK2JAK3
SCHEMBL20552900 0.72 ABL1 (0.38) GAAABL1BCRBRAFPDK2
SCHEMBL20551995 0.71 YAP1 (0.47) GAADHODHALDH1A1LMNAMAPT
SCHEMBL21764712 0.70 PDK2 (0.50) PDK2PDK1PDK3JAK2JAK3

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 GAA 3205/4885ABL1 4691/4885BCR 2787/4885

“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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