SCHEMBL5813383

SCHEMBL5813383

CCOC(=O)[C@H](CC(C)C)NC(C)=O

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.60
PPID Q08752 1/20 0.50
TAS1R3 Q7RTX0 4/20 0.44
TAS1R1 Q7RTX1 4/20 0.44
CAD P27708 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
BIRC2 Q13490 1/20 0.42
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
CAPN9 O14815 1/20 0.40

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
SCHEMBL5813379 1.00 ALDH1A1 (0.60) ALDH1A1PPIDTAS1R3TAS1R1CAD
SCHEMBL5814137 0.85 ALDH1A1 (0.56) ALDH1A1PPIDTAS1R3TAS1R1BIRC2
SCHEMBL5814142 0.85 ALDH1A1 (0.56) ALDH1A1PPIDTAS1R3TAS1R1BIRC2
SCHEMBL16316785 0.85 PPID (0.48) ALDH1A1PPIDTAS1R3TAS1R1CAD
SCHEMBL6900424 0.85 PPID (0.50) ALDH1A1PPIDTAS1R3TAS1R1CAD
SCHEMBL5812880 0.84 ALDH1A1 (0.64) ALDH1A1TAS1R3TAS1R1BIRC2POLB
SCHEMBL245758 0.84 ALDH1A1 (0.64) ALDH1A1TAS1R3TAS1R1BIRC2POLB
SCHEMBL11316551 0.84 ALDH1A1 (0.64) ALDH1A1TAS1R3TAS1R1BIRC2POLB
SCHEMBL14902193 0.84 L3MBTL1 (0.50) ALDH1A1PPIDTAS1R3TAS1R1CAD
SCHEMBL8310678 0.83 PPID (0.49) ALDH1A1PPIDTAS1R3TAS1R1CAD

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015000076-A9 PHOTOCHEMICAL PROCESS FOR THE FLUORINATION OF AN ORGANIC COMPOUND HAVING AN UNACTIVATED SP3 C-H BOND ALECTOS THERAPEUTICS INC. (CA) 2015-08-06 WO claimed
WO-2015000076-A1 PHOTOCHEMICAL PROCESS FOR THE FLUORTNATION OF AN ORGANIC COMPOUND HAVING AN UNACTIVATED SP3 C-H BOND ALECTOS THERAPEUTICS INC. (CA) 2015-01-08 WO claimed
WO-2006119283-A2 ANTI-ODOR COMPOSITIONS AND THERAPEUTIC USE YU RUEY J (US) 2006-11-09 WO claimed
US-20060251597-A1 ANTI-ODOR COMPOSITIONS AND THERAPEUTIC USE YU RUEY J 2006-11-09 US claimed
US-20250352496-A1 PHARMACEUTICAL COMPOSITIONS AND ORAL DOSAGE FORMS OF KETAMINE DERIVATIVES XWPHARMA LTD (KY) 2025-11-20 US disclosed
US-12396966-B2 Pharmaceutical compositions and oral dosage forms of ketamine derivatives XWPharma Ltd. (KY) 2025-08-26 US disclosed
EP-4559522-A2 PHARMACEUTICAL COMPOSITIONS AND ORAL DOSAGE FORMS OF KETAMINE DERIVATIVES XWPharma Ltd. (KY) 2025-05-28 EP disclosed
EP-4384145-B1 PHARMACEUTICAL COMPOSITIONS AND ORAL DOSAGE FORMS OF KETAMINE DERIVATIVES XWPHARMA LTD (KY) 2025-04-23 EP disclosed
EP-4384145-A1 PHARMACEUTICAL COMPOSITIONS AND ORAL DOSAGE FORMS OF KETAMINE DERIVATIVES XWPharma Ltd. (KY) 2024-06-19 EP disclosed
US-20230285325-A1 PHARMACEUTICAL COMPOSITIONS AND ORAL DOSAGE FORMS OF KETAMINE DERIVATIVES XWPharma Ltd. (KY) 2023-09-14 US disclosed
US-11690811-B2 Pharmaceutical compositions and oral dosage forms of ketamine derivatives XWPharma Ltd. (KY) 2023-07-04 US disclosed
US-20230098084-A1 PHARMACEUTICAL COMPOSITIONS AND ORAL DOSAGE FORMS OF KETAMINE DERIVATIVES XWPharma Ltd. (KY) 2023-03-30 US disclosed
WO-2017093544-A1 ALKYNYL PHOSPHINE GOLD COMPLEXES FOR TREATING BACTERIAL INFECTIONS AUSPHERIX LIMITED (GB) 2017-06-08 WO disclosed
WO-2015000076-A9 PHOTOCHEMICAL PROCESS FOR THE FLUORINATION OF AN ORGANIC COMPOUND HAVING AN UNACTIVATED SP3 C-H BOND ALECTOS THERAPEUTICS INC. (CA) 2015-08-06 WO disclosed
WO-2015000076-A9 PHOTOCHEMICAL PROCESS FOR THE FLUORINATION OF AN ORGANIC COMPOUND HAVING AN UNACTIVATED SP3 C-H BOND ALECTOS THERAPEUTICS INC. (CA) 2015-08-06 WO disclosed
WO-2015000076-A1 PHOTOCHEMICAL PROCESS FOR THE FLUORTNATION OF AN ORGANIC COMPOUND HAVING AN UNACTIVATED SP3 C-H BOND ALECTOS THERAPEUTICS INC. (CA) 2015-01-08 WO disclosed
WO-2015000076-A1 PHOTOCHEMICAL PROCESS FOR THE FLUORTNATION OF AN ORGANIC COMPOUND HAVING AN UNACTIVATED SP3 C-H BOND ALECTOS THERAPEUTICS INC. (CA) 2015-01-08 WO disclosed
WO-2006119283-A2 ANTI-ODOR COMPOSITIONS AND THERAPEUTIC USE YU RUEY J (US) 2006-11-09 WO disclosed
US-20060251597-A1 ANTI-ODOR COMPOSITIONS AND THERAPEUTIC USE YU RUEY J 2006-11-09 US disclosed
US-RE29843-E Substituted thiazoles and flavoring processes and products produced thereby INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-11-21 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 (5 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-11690811-B2 Pharmaceutical compositions and oral dosage forms of ketamine derivatives OPRK1, KCNK5, KCNK17 ALDH1A1 2360/4885PPID 3287/4885TAS1R3 925/4885
US-12396966-B2 Pharmaceutical compositions and oral dosage forms of ketamine derivatives OPRK1, KCNK5, KCNK17 ALDH1A1 2360/4885PPID 3287/4885TAS1R3 925/4885
US-20250352496-A1 PHARMACEUTICAL COMPOSITIONS AND ORAL DOSAGE FORMS OF KETAMINE DERIVATIVES OPRK1, KCNK5, KCNK17 ALDH1A1 2360/4885PPID 3287/4885TAS1R3 925/4885
US-20230098084-A1 PHARMACEUTICAL COMPOSITIONS AND ORAL DOSAGE FORMS OF KETAMINE DERIVATIVES OPRK1, KCNK5, KCNK17 ALDH1A1 2360/4885PPID 3287/4885TAS1R3 925/4885
US-20230285325-A1 PHARMACEUTICAL COMPOSITIONS AND ORAL DOSAGE FORMS OF KETAMINE DERIVATIVES OPRK1, KCNK5, KCNK17 ALDH1A1 2360/4885PPID 3287/4885TAS1R3 925/4885

“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.