SCHEMBL25525530

SCHEMBL25525530

CC(C)N[C@H]1C[C@@](C)(N2CCCC2=O)C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.35
NPY1R P25929 1/20 0.33
SLC6A4 P31645 1/20 0.33
BRD4 O60885 1/20 0.33
BRD2 P25440 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PKM P14618 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
LMNA P02545 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA3 P07451 1/20 0.31
CA4 P22748 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
SCHEMBL25525529 1.00 PIK3CD (0.35) PIK3CDNPY1RSLC6A4BRD4BRD2
SCHEMBL25517929 0.81
SCHEMBL25517930 0.81
SCHEMBL25157379 0.79 BRD4 (0.40) PIK3CDBRD4BRD2MEN1KMT2A
SCHEMBL25157210 0.71 BRD4 (0.43) PIK3CDBRD4BRD2ALDH1A1CHRM2
SCHEMBL22857097 0.70 PIK3CD (0.37) PIK3CDBRD4BRD2ALDH1A1LMNA
SCHEMBL2999035 0.70 BRD4 (0.41) PIK3CDBRD4BRD2KMT2AALDH1A1
SCHEMBL25157105 0.69 ALDH1A1 (0.41) PIK3CDBRD4BRD2ALDH1A1
SCHEMBL25157655 0.67 BRD4 (0.39) PIK3CDBRD4BRD2ALDH1A1
SCHEMBL22857098 0.66 PIK3CD (0.37) PIK3CDBRD4BRD2ALDH1A1CHRM2

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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF VICKERS VENTURE FUND VI PTE. LTD. (SG) 2023-06-01 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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF DYRK1A, DYRK1B, DYRK2 PIK3CD 1356/4885NPY1R 83/4885SLC6A4 3754/4885

“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.