SCHEMBL30664862

SCHEMBL30664862

CN[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1COC

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.36
EPHX1 P07099 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
HPGD P15428 1/20 0.34
ALDH1A1 P00352 2/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL29222288 1.00 HCRTR2 (0.40) HCRTR2SMN1; SMN2EPHX1HSD17B10CHRM2
SCHEMBL24918246 1.00 HCRTR2 (0.40) HCRTR2SMN1; SMN2EPHX1HSD17B10CHRM2
SCHEMBL31239802 0.86 SMN1; SMN2 (0.38) HCRTR2SMN1; SMN2EPHX1HSD17B10CHRM2
SCHEMBL31239832 0.84 SMN1; SMN2 (0.37) HCRTR2SMN1; SMN2EPHX1HSD17B10CHRM2
SCHEMBL26656268 0.81 HCRTR2 (0.31) HCRTR2
SCHEMBL24918211 0.78 HPGD (0.41) SMN1; SMN2EPHX1HSD17B10CHRM2CHRM1
SCHEMBL24917703 0.78 HPGD (0.41) SMN1; SMN2EPHX1HSD17B10CHRM2CHRM1
SCHEMBL31239951 0.78 HPGD (0.41) SMN1; SMN2EPHX1HSD17B10CHRM2CHRM1
SCHEMBL24917728 0.78 HPGD (0.41) SMN1; SMN2EPHX1HSD17B10CHRM2CHRM1
SCHEMBL31239988 0.78 HPGD (0.41) SMN1; SMN2EPHX1HSD17B10CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4705302-A1 PYRIDO[4,3-D]PYRIMIDINE DERIVATIVES AS MUTANT KRAS G12C INHIBITORS FOR THE TREATMENT OF CANCER Frontier Medicines Corporation (US) 2026-03-11 EP disclosed
US-20250270206-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF RAS NNSA 2025-08-28 US disclosed
WO-2024229447-A1 PYRIDO[4,3-D]PYRIMIDINE DERIVATIVES AS MUTANT KRAS G12C INHIBITORS FOR THE TREATMENT OF CANCER FRONTIER MEDICINES CORPORATION (US) 2024-11-07 WO disclosed
CN-117916238-A Compositions and methods for inhibiting RAS 瑟拉斯有限公司 2024-04-19 CN disclosed
WO-2023225252-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF RAS THERAS, INC. (US) 2023-11-23 WO 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-20250270206-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF RAS KRAS, NRAS, HRAS HCRTR2 4695/4885SMN1; SMN2 2634/4885EPHX1 662/4885

“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.