SCHEMBL25972074

SCHEMBL25972074

CC1CN(C(=O)c2ccc(C(C)(C)C)cn2)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.45
▸ RBP4 P02753 1/20 0.43
▸ PLA2G1B P04054 1/20 0.42
▸ ATG4B Q9Y4P1 1/20 0.42
▸ GAA P10253 2/20 0.41
▸ PDE10A Q9Y233 1/20 0.39
▸ SCN9A Q15858 6/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ PDK1 Q15118 1/20 0.38
▸ PDK2 Q15119 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ HPGD P15428 2/20 0.37
▸ L3MBTL3 Q96JM7 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ CHRNB2 P17787 1/20 0.37
▸ CHRNB4 P30926 1/20 0.37

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
SCHEMBL25972070 0.89 ALDH1A1 (0.49) ALDH1A1RBP4PLA2G1BATG4BGAA
SCHEMBL23880060 0.88 SCN9A (0.46) ALDH1A1RBP4PLA2G1BATG4BPDE10A
SCHEMBL25972082 0.86 HPGD (0.50) ALDH1A1RBP4PLA2G1BATG4BGAA
SCHEMBL23880056 0.86 ALDH1A1 (0.48) ALDH1A1RBP4PLA2G1BATG4BPDE10A
SCHEMBL25972071 0.83 ALDH1A1 (0.47) ALDH1A1RBP4PLA2G1BATG4BPDE10A
SCHEMBL23880061 0.81 SCN9A (0.49) ALDH1A1PLA2G1BATG4BSCN9ASMN1; SMN2
SCHEMBL23880057 0.80 SCN9A (0.47) ALDH1A1RBP4PLA2G1BATG4BSCN9A
SCHEMBL2733495 0.78 SMN1; SMN2 (0.65) ALDH1A1GAASCN9ASMN1; SMN2MEN1
SCHEMBL15470635 0.76 MEN1 (0.63) ALDH1A1PLA2G1BATG4BGAASMN1; SMN2
SCHEMBL23880068 0.76 SCN9A (0.49) ALDH1A1SCN9ASMN1; SMN2MEN1HTT

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-11725012-B2 Imidazo[1,5-a]pyrazine derivatives as PI3K δ inhibitors BEIGENE, LTD. (KY) 2023-08-15 — — 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-11725012-B2 Imidazo[1,5-a]pyrazine derivatives as PI3K δ inhibitors PIK3CD, PIK3R5, PIK3CA ALDH1A1 1955/4885RBP4 4745/4885PLA2G1B 1312/4885

“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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