SCHEMBL8747853

SCHEMBL8747853

CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)[O-].[Na+]

nearest known ligand 0.55

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 known ✓ P00918 3/20 0.50
CA1 known ✓ P00915 2/20 0.50
CA4 known ✓ P22748 1/20 0.38
CTSK P43235 5/20 0.54
CTSS P25774 2/20 0.54
CA7 P43166 2/20 0.50
PREP P48147 1/20 0.47
TRPA1 O75762 2/20 0.46
CTSL P07711 1/20 0.46
CTSB P07858 1/20 0.46
CYP2D6 P10635 1/20 0.45
PSENEN Q9NZ42 1/20 0.39
ELANE P08246 1/20 0.39
CA9 Q16790 1/20 0.38

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
SCHEMBL25284328 0.96 CTSK (0.54) CTSKCTSSCA2CA1CA7
SCHEMBL15488528 0.96 CTSK (0.54) CTSKCTSSCA2CA1CA7
SCHEMBL30485856 0.96 CTSK (0.54) CTSKCTSSCA2CA1CA7
Silver SCHEMBL38661815 0.96 CTSK (0.54) CTSKCTSSCA2CA1CA7
Potassium Ion SCHEMBL7881660 0.96 CTSK (0.54) CTSKCTSSCA2CA1CA7
SCHEMBL5969791 0.84 CTSK (0.45) CTSKCTSSCA2CA1CA7
SCHEMBL10192146 0.81 CTSK (0.57) CTSKCTSSCA2CA1CA7
SCHEMBL12730505 0.81 CTSK (0.57) CTSKCTSSCA2CA1CA7
SCHEMBL8747766 0.81 CA1 (0.49) CTSKCTSSCA2CA1CA7
SCHEMBL59323 0.81 CTSK (0.61) CTSKCTSSCA2CA1CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12590065-B2 Levorphanol prodrugs and processes for making and using them ZEVRA THERAPEUTICS, INC. (US) 2026-03-31 US disclosed
US-20240317688-A1 DEXTRORPHAN PRODRUGS AND PROCESSES FOR MAKING AND USING THEM ZEVRA THERAPEUTICS, INC. 2024-09-26 US disclosed
US-12012384-B2 Dextrorphan prodrugs and processes for making and using them ZEVRA THERAPEUTICS, INC. (US) 2024-06-18 US disclosed
US-20220089544-A1 DEXTRORPHAN PRODRUGS AND PROCESSES FOR MAKING AND USING THEM ALTER DOMUS (US) LLC 2022-03-24 US disclosed
EP-0424899-B1 Novel anthracycline glycoside derivatives and preparing method thereof DONG A PHARM CO LTD (KR) 1997-01-22 EP disclosed
US-5220001-A Antitumor agents ZAIDAN HOJIM BISEIBUTSU DONG-A PHARM CO. (KR) 1993-06-15 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 (4 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-12012384-B2 Dextrorphan prodrugs and processes for making and using them OGFR, OPRM1, CYP4F3 CA2 2431/4885CA1 408/4885CA4 1902/4885
US-12590065-B2 Levorphanol prodrugs and processes for making and using them SLC16A3, SLC16A8, SLC16A1 CA2 321/4885CA1 379/4885CA4 80/4885
US-20240317688-A1 DEXTRORPHAN PRODRUGS AND PROCESSES FOR MAKING AND USING THEM OPRM1, OPRL1, OGFR CA2 2996/4885CA1 826/4885CA4 2286/4885
US-20220089544-A1 DEXTRORPHAN PRODRUGS AND PROCESSES FOR MAKING AND USING THEM OGFR, OPRM1, CYP4F3 CA2 2431/4885CA1 408/4885CA4 1902/4885

“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.