SCHEMBL31428869

SCHEMBL31428869

COc1cc(OCC(N)=O)ccc1C=C1C(=O)c2ccccc2N1C(C)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ MEN1 O00255 6/20 0.43
▸ KMT2A Q03164 6/20 0.43
▸ POLB P06746 2/20 0.43
▸ GAA P10253 1/20 0.40
▸ PAX8 Q06710 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ CES1 P23141 1/20 0.39
▸ MAOB P27338 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ MDM2 Q00987 1/20 0.38
▸ ACACA Q13085 1/20 0.37
▸ PSMD14 O00487 1/20 0.37
▸ RAB9A P51151 1/20 0.36

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
SCHEMBL31428762 0.89 MAPT (0.47) MAPTMAPK1TDP1ALDH1A1SMN1; SMN2
SCHEMBL31428577 0.85 ALDH1A1 (0.50) MAPTMAPK1TDP1ALDH1A1SMN1; SMN2
SCHEMBL31428705 0.83 ALDH1A1 (0.61) MAPTMAPK1TDP1ALDH1A1SMN1; SMN2
SCHEMBL31429004 0.82 MAPT (0.53) MAPTMAPK1TDP1ALDH1A1SMN1; SMN2
SCHEMBL30163485 0.82 MAPT (0.53) MAPTMAPK1TDP1ALDH1A1SMN1; SMN2
SCHEMBL31428668 0.77 ALDH1A1 (0.53) MAPTMAPK1TDP1ALDH1A1SMN1; SMN2
SCHEMBL31428526 0.76 ALDH1A1 (0.53) MAPTMAPK1TDP1ALDH1A1SMN1; SMN2
SCHEMBL31428589 0.76 MAPT (0.53) MAPTMAPK1TDP1ALDH1A1SMN1; SMN2
SCHEMBL31428729 0.75 ALDH1A1 (0.54) MAPTMAPK1TDP1ALDH1A1SMN1; SMN2
SCHEMBL30163499 0.75 MAPT (0.56) MAPTMAPK1TDP1ALDH1A1SMN1; SMN2

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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2025-03-20 — — 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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND BRAF, RAF1, NRAS MAPT 4513/4885MAPK1 140/4885TDP1 3630/4885

“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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