SCHEMBL25456203

SCHEMBL25456203

C[C@H](COCC(C)(C)c1ccc2nc(NC(=O)C(C)(C)C)ncc2c1)Nc1ncc2cc(C(C)(C)C)ccc2n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 4/20 0.35
▸ PIK3CA P42336 1/20 0.33
▸ MEN1 O00255 4/20 0.32
▸ KMT2A Q03164 4/20 0.32
▸ PAX8 Q06710 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ SCN10A Q9Y5Y9 3/20 0.32
▸ SYK P43405 1/20 0.32
▸ ADORA1 P30542 1/20 0.32
▸ LCK P06239 2/20 0.32
▸ HTT P42858 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ KDR P35968 1/20 0.30
▸ JAK3 P52333 1/20 0.30
▸ MAPK14 Q16539 1/20 0.30
▸ TRPV1 Q8NER1 1/20 0.30
▸ KIT P10721 1/20 0.30

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
SCHEMBL25449359 0.83 ADORA1 (0.43) BRAFPIK3CAMEN1KMT2ASCN10A
SCHEMBL25449363 0.75 SCN10A (0.40) BRAFSCN10ASYKMAPK1KDR
SCHEMBL12755258 0.73 PIK3CA (0.54) BRAFPIK3CAMEN1KMT2ASCN10A
SCHEMBL21864816 0.70 SYK (0.44) BRAFPIK3CAMEN1KMT2ASYK
SCHEMBL10828998 0.70 KMT2A (0.46) BRAFPIK3CAMEN1KMT2AADORA1
SCHEMBL30216052 0.69 MAPT (0.46) BRAFPIK3CAMEN1KMT2AADORA1
SCHEMBL21864813 0.69 MAPT (0.46) BRAFPIK3CAMEN1KMT2AADORA1
SCHEMBL25449364 0.68 LCK (0.41) BRAFSCN10ALCKKDRJAK3
SCHEMBL25449358 0.66 RPS6KB1 (0.54) MAPK1
SCHEMBL25449365 0.66 RPS6KB1 (0.54) MAPK1

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-20230143059-A1 GCN2 MODULATOR COMPOUNDS Alesta Therapeutics BV (NL) 2023-05-11 — — 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-20230143059-A1 GCN2 MODULATOR COMPOUNDS EIF2AK4, GPR119, GCN1 BRAF 3070/4885PIK3CA 2491/4885MEN1 3566/4885

“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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