SCHEMBL25839431

SCHEMBL25839431

CC(=O)N1CCN(c2ccc(C(C)C)cc2)C[C@H]1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
MAPK1 P28482 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
ALOX12 P18054 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PANK3 Q9H999 3/20 0.44
ALDH1A1 P00352 2/20 0.44
TP53 P04637 1/20 0.44
THRB P10828 1/20 0.44
SYK P43405 1/20 0.44
ACACB O00763 6/20 0.41
BRD4 O60885 1/20 0.41
SMARCA2 P51531 1/20 0.41

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
SCHEMBL23544890 1.00 MAPT (0.46) MAPTMAPK1SMN1; SMN2LMNAL3MBTL1
SCHEMBL14320597 0.85 GFER (0.58) MAPTMAPK1SMN1; SMN2LMNAKDM4E
SCHEMBL17324966 0.82 FAAH (0.53) MAPTMAPK1SMN1; SMN2LMNAKDM4E
SCHEMBL26870516 0.82 FAAH (0.53) SMN1; SMN2SYKBRD4SMARCA2SMARCA4
SCHEMBL17324998 0.82 FAAH (0.53) SMN1; SMN2SYKBRD4SMARCA2SMARCA4
SCHEMBL25839430 0.81 L3MBTL1 (0.43) MAPTMAPK1SMN1; SMN2LMNAL3MBTL1
SCHEMBL377936 0.80 ALDH1A1 (0.50) SMN1; SMN2KDM4EALDH1A1SYKBRD4
SCHEMBL23544879 0.80 MAPT (0.49) MAPTMAPK1SMN1; SMN2LMNAKDM4E
SCHEMBL24352439 0.77 ADRA2A (0.43) L3MBTL1
SCHEMBL29310072 0.77 ADRA2A (0.43) L3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11697648-B2 Fused pyrimidine pyridinone compounds as JAK inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-07-11 US disclosed
US-11697648-B2 Fused pyrimidine pyridinone compounds as JAK inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-07-11 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-11697648-B2 Fused pyrimidine pyridinone compounds as JAK inhibitors JAK3, JAK1, JAK2 MAPT 3409/4885MAPK1 126/4885SMN1; SMN2 3707/4885

“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.