SCHEMBL26894780

SCHEMBL26894780

CN1CCC(C(N)=O)C(O)C1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 1/20 0.36
▸ NCF1 P14598 1/20 0.34
▸ SLC6A2 P23975 4/20 0.33
▸ SLC6A4 P31645 4/20 0.33
▸ SLC6A3 Q01959 4/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ BCHE P06276 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32

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
Hydrochloric Acid SCHEMBL27903858 0.98 EPHX1 (0.35) EPHX1NCF1SLC6A2SLC6A4SLC6A3
SCHEMBL14311906 0.84 SLC6A2 (0.36) EPHX1NCF1SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL14311983 0.82 ALDH1A1 (0.38) EPHX1NCF1SLC6A2SLC6A4SLC6A3
SCHEMBL15592009 0.82 ALDH1A1 (0.40) SLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL14311988 0.78 EPHX1 (0.35) EPHX1NCF1SLC6A2SLC6A4SLC6A3
SCHEMBL23269569 0.78 EPHX1 (0.38) EPHX1NCF1SLC6A2SLC6A4SLC6A3
SCHEMBL19781548 0.78 EPHX1 (0.38) EPHX1NCF1SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL14311817 0.77 EPHX1 (0.34) EPHX1NCF1SLC6A2SLC6A4SLC6A3
SCHEMBL14888125 0.76 SLC6A2 (0.37) EPHX1SLC6A2SLC6A4SLC6A3SMN1; SMN2
SCHEMBL24733196 0.76 EPHX1 (0.35) EPHX1SMN1; SMN2ALDH1A1

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-11912723-B2 KRAS modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2024-02-27 — — US disclosed
US-20230374042-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2023-11-23 — — 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-20230374042-A1 KRAS MODULATORS AND USES THEREOF KRAS, NRAS, HRAS EPHX1 2695/4885NCF1 1608/4885SLC6A2 4707/4885
US-11912723-B2 KRAS modulators and uses thereof KRAS, NRAS, HRAS EPHX1 2695/4885NCF1 1608/4885SLC6A2 4707/4885

“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.

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