SCHEMBL23217920

SCHEMBL23217920

O=C(O)C1CCCN1C(=O)OCCl

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.65
▸ ALDH1A1 P00352 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ ACE P12821 10/20 0.49
▸ REN P00797 3/20 0.46
▸ LMNA P02545 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ F2 P00734 1/20 0.46
▸ LTA4H P09960 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ PEPD P12955 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ PTGS1 P23219 1/20 0.46
▸ HTR2A P28223 1/20 0.46
▸ PTGS2 P35354 1/20 0.46
▸ HRH1 P35367 1/20 0.46
▸ THPO P40225 1/20 0.46
▸ PMP22 Q01453 1/20 0.46

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
SCHEMBL23217918 0.88 RAB9A (0.50) RAB9AALDH1A1SMN1; SMN2
SCHEMBL7406144 0.84 RAB9A (0.71) RAB9AALDH1A1SMN1; SMN2ACEREN
SCHEMBL3172593 0.84 RAB9A (0.71) RAB9AALDH1A1SMN1; SMN2ACEREN
SCHEMBL3172600 0.84 RAB9A (0.71) RAB9AALDH1A1SMN1; SMN2ACEREN
SCHEMBL28836255 0.83 RAB9A (0.61) RAB9AALDH1A1SMN1; SMN2ACEREN
SCHEMBL7367598 0.83 RAB9A (0.61) RAB9AALDH1A1SMN1; SMN2ACEREN
Hydrochloric Acid SCHEMBL27968384 0.83 RAB9A (0.69) RAB9AALDH1A1SMN1; SMN2ACEREN
Hydrochloric Acid SCHEMBL28049456 0.83 RAB9A (0.69) RAB9AALDH1A1SMN1; SMN2ACEREN
SCHEMBL1976765 0.82 POLB (0.50) RAB9AALDH1A1SMN1; SMN2LMNAPEPD
SCHEMBL30070875 0.81 RAB9A (0.55) RAB9AALDH1A1SMN1; SMN2ACEREN

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-20240067651-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS BIOHAVEN THERAPEUTICS LTD. 2024-02-29 — — US disclosed
WO-2021072140-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS BIOHAVEN THERAPEUTICS LTD. (US) 2021-04-15 — — 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-20240067651-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS MPO, CAT, SOD1 RAB9A 2417/4885ALDH1A1 570/4885SMN1; SMN2 80/4885

“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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