SCHEMBL31208922

SCHEMBL31208922

CO[C@H]1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.47
HPGD P15428 1/20 0.43
PIK3CD O00329 2/20 0.41
RECQL P46063 1/20 0.41
EPHX1 P07099 1/20 0.41
PDE4B Q07343 1/20 0.41
CCNT1 O60563 1/20 0.41
CDK9 P50750 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GPR119 Q8TDV5 1/20 0.39
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38

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
SCHEMBL21871866 0.93 HPGD (0.47) USP30HPGDRECQLEPHX1ALDH1A1
SCHEMBL18609897 0.93 HPGD (0.47) USP30HPGDRECQLEPHX1ALDH1A1
SCHEMBL16365614 0.93 USP30 (0.46) USP30HPGDPIK3CDRECQLEPHX1
SCHEMBL31208882 0.93 USP30 (0.46) USP30HPGDPIK3CDRECQLEPHX1
SCHEMBL31085625 0.92 HPGD (0.44) USP30HPGDPIK3CDRECQLEPHX1
SCHEMBL316685 0.87 HPGD (0.50) USP30HPGDPIK3CDRECQLEPHX1
SCHEMBL316684 0.87 HPGD (0.50) USP30HPGDPIK3CDRECQLEPHX1
SCHEMBL84791 0.87 HPGD (0.50) USP30HPGDPIK3CDRECQLEPHX1
SCHEMBL7811814 0.84 NR1H2 (0.43) USP30HPGDPIK3CDRECQLEPHX1
SCHEMBL12526367 0.84 HPGD (0.49) HPGDRECQLEPHX1ALDH1A1MAPT

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-20240368193-A1 KRAS INHIBITORS ELI LILLY AND COMPANY 2024-11-07 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-20240368193-A1 KRAS INHIBITORS KRAS, NRAS, HRAS USP30 2132/4885HPGD 2249/4885PIK3CD 588/4885

“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.