SCHEMBL31209040

SCHEMBL31209040

CC(C)NC1CN(C(=O)OC(C)(C)C)CC12COC2

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RECQL P46063 1/20 0.36
EPHX1 P07099 1/20 0.36
NR1H2 P55055 1/20 0.36
HPGD P15428 1/20 0.35
EPHX2 P34913 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
HTT P42858 2/20 0.34
NPC1 O15118 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RORC P51449 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CCR2 P41597 2/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL31209707 0.88 EPHX1 (0.39) USP2SMN1; SMN2EPHX1NR1H2HPGD
SCHEMBL31209512 0.88 EPHX1 (0.39) USP2SMN1; SMN2EPHX1NR1H2HPGD
SCHEMBL31209428 0.79 EPHX2 (0.38) USP2SMN1; SMN2EPHX1NR1H2HPGD
SCHEMBL30738959 0.77 USP2 (0.43) USP2SMN1; SMN2RECQLNR1H2ALDH1A1
SCHEMBL31209365 0.76 USP2 (0.42) USP2SMN1; SMN2RECQLEPHX1NR1H2
SCHEMBL17107692 0.74 EPHX1 (0.39) USP2SMN1; SMN2RECQLEPHX1NR1H2
SCHEMBL3178498 0.73 EPHX1 (0.41) USP2SMN1; SMN2EPHX1NR1H2HPGD
SCHEMBL3186800 0.72 EPHX1 (0.43) USP2SMN1; SMN2EPHX1NR1H2HPGD
SCHEMBL3190015 0.72 EPHX1 (0.40) EPHX1NR1H2HPGDEPHX2ALDH1A1
SCHEMBL29589441 0.71 EHMT2 (0.44) USP2SMN1; SMN2RECQLEPHX1NR1H2

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 USP2 3256/4885SMN1; SMN2 4044/4885RECQL 210/4885

“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.