SCHEMBL33525876

SCHEMBL33525876

C[C@H]1C(N2CCC2)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.41
HPGD P15428 1/20 0.40
OPRK1 P41145 1/20 0.40
CTSK P43235 1/20 0.39
EPHX1 P07099 1/20 0.38
CHRM2 P08172 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
PREP P48147 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
NPC1 O15118 1/20 0.36

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
SCHEMBL33525545 0.97 HPGD (0.43) HSD17B10HPGDOPRK1EPHX1CHRM2
SCHEMBL31085636 0.88 HSD17B10 (0.36) HSD17B10HPGDOPRK1EPHX1CHRM2
SCHEMBL31208605 0.88 HSD17B10 (0.36) HSD17B10HPGDOPRK1EPHX1CHRM2
SCHEMBL31085807 0.88 HSD17B10 (0.36) HSD17B10HPGDOPRK1EPHX1CHRM2
SCHEMBL31085624 0.88 HSD17B10 (0.36) HSD17B10HPGDOPRK1EPHX1CHRM2
SCHEMBL24700253 0.88 HSD17B10 (0.45) HSD17B10HPGDOPRK1EPHX1SMN1; SMN2
SCHEMBL31208855 0.87 USP2 (0.50) HSD17B10HPGDOPRK1CHRM2CHRM1
SCHEMBL33527004 0.85 HSD17B10 (0.38) HSD17B10HPGDOPRK1EPHX1CHRM2
SCHEMBL33525498 0.85 HSD17B10 (0.38) HSD17B10HPGDOPRK1EPHX1CHRM2
SCHEMBL31209419 0.84 HRH3 (0.45) HSD17B10HPGDOPRK1CHRM2CHRM1

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-12600733-B2 KRAS inhibitors ELI LILLY AND COMPANY (US) 2026-04-14 US disclosed
US-20260092075-A1 KRAS INHIBITORS LILLY CO ELI (US) 2026-04-02 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 (2 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-12600733-B2 KRAS inhibitors KRAS, NRAS, HRAS HSD17B10 3639/4885HPGD 3490/4885OPRK1 1587/4885
US-20260092075-A1 KRAS INHIBITORS KRAS, NRAS, HRAS HSD17B10 3739/4885HPGD 3192/4885OPRK1 1838/4885

“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.