SCHEMBL462065

SCHEMBL462065

O=[C]CC1CCCCC1C[C]=O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
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
SCHEMBL910613 0.82 CA1 (0.46)
SCHEMBL28923763 0.78
SCHEMBL6450709 0.78 CYP1A2 (0.38)
SCHEMBL8789060 0.77 PEPD (0.38) ALDH1A1
SCHEMBL910836 0.77 KDM4E (0.36)
SCHEMBL7314132 0.76
SCHEMBL98027 0.75
SCHEMBL29203936 0.73 ADH1B (0.37) ALDH1A1
SCHEMBL2439565 0.73 ADH1B (0.37) ALDH1A1
SCHEMBL26243 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9416084-B2 Method of producing ingenol-3-angelate LEO LABORATORIES LIMITED (IE) 2016-08-16 US claimed
EP-1670809-B1 SYNTHESIS AND MANUFACTURE OF PENTOSTATIN AND ITS PRECURSORS, ANALOGS AND DERIVATIVES MAYNE PHARMA PLC (GB) 2016-01-13 EP claimed
JP-4830128-B2 2011-12-07 JP claimed
EP-1670809-A2 SYNTHESIS AND MANUFACTURE OF PENTOSTATIN AND ITS PRECURSORS, ANALOGS AND DERIVATIVES SuperGen, Inc. (US) 2006-06-21 EP claimed
US-20050267056-A1 Synthesis and manufacture of pentostatin and its precursors, analogs and derivatives MAYNE PHARMA (USA) INC. 2005-12-01 US claimed
WO-2005027838-A2 SYNTHESIS AND MANUFACTURE OF PENTOSTATIN AND ITS PRECURSORS, ANALOGS AND DERIVATIVES SUPERGEN, INC. (US) 2005-03-31 WO claimed
US-12006311-B2 Compounds for use in preventing or treating cancer FUNDACIÓ HOSPITAL UNIVERSITARI VALL D'HEBRONINSTITUT DE RECERCA (ES) 2024-06-11 US disclosed
CN-117986153-A Ionizable cationic lipid compound, and preparation method and application thereof 晟迪生物医药(苏州)有限公司 2024-05-07 CN disclosed
WO-2024083861-A1 1-(SULFONYL)-N-PHENYLPYRROLIDINE-2-CARBOXAMIDES DERIVATIVES AND USE THEREOF SELABTEC SCIENCES, SLU (ES) 2024-04-25 WO disclosed
EP-4356909-A1 1-(SULFONYL)-N-PHENYLPYRROLIDINE-2-CARBOXAMIDES DERIVATIVES AND USE THEREOF Selabtec Sciences, SLU (ES) 2024-04-24 EP disclosed
CN-111032671-B Protected tetraose, method for the production thereof and use thereof as a substrate for transglucosidase receptors in the chemoenzymatic synthesis of shigella flexneri-specific oligosaccharides 巴斯德研究所 2024-01-12 CN disclosed
US-20240002423-A1 PROTECTED TETRASACCHARIDES, THEIR PROCESS OF PREPARATION AND THEIR USE AS TRANSGLUCOSYLASE ACCEPTOR SUBSTRATES IN THE CHEMO-ENZYMATIC SYNTHESIS OF SHIGELLA FLEXNERI SPECIFIC OLIGOSACCHARIDES PASTEUR INSTITUT (FR) 2024-01-04 US disclosed
US-11834468-B2 Protected tetrasaccharides, their process of preparation and their use as transglucosylase acceptor substrates in the chemo-enzymatic synthesis of Shigella flexneri specific oligosaccharides INSTITUT PASTEUR (FR) 2023-12-05 US disclosed
WO-2005027838-A2 SYNTHESIS AND MANUFACTURE OF PENTOSTATIN AND ITS PRECURSORS, ANALOGS AND DERIVATIVES SUPERGEN, INC. (US) 2005-03-31 WO disclosed
EP-1409500-A1 ALKYLATED INOSITOLGLYCANS AND THEIR USES Rodaris Pharmaceuticals Limited (GB) 2004-04-21 EP disclosed
EP-1406913-A2 INOSITOLGLYCANS AND THEIR USES Rodaris Pharmaceuticals Limited (GB) 2004-04-14 EP disclosed
US-20010053767-A1 Compounds and their uses RODARIS PHARMACEUTICALS LIMITED (GB) 2001-12-20 US disclosed
US-20010051606-A1 Compounds and their uses RADEMACHER GROUP LIMITED (GB) 2001-12-13 US disclosed
WO-2001085747-A1 ALKYLATED INOSITOLGLYCANS AND THEIR USE RODARIS PHARMACEUTICALS LIMITED (GB) 2001-11-15 WO disclosed
WO-2001085740-A2 INOSITOLGLYCANS AND THEIR USES RODARIS PHARMACEUTICALS LIMITED (GB) 2001-11-15 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 (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-11834468-B2 Protected tetrasaccharides, their process of preparation and their use as transglucosylase acceptor substrates in the chemo-enzymatic synthesis of Shigella flexneri specific oligosaccharides SI, GALE, FUT5 ALDH1A1 1374/4885
US-12006311-B2 Compounds for use in preventing or treating cancer UGT1A3, UGT1A1, UGT1A6 ALDH1A1 14/4885
US-20050267056-A1 Synthesis and manufacture of pentostatin and its precursors, analogs and derivatives UMPS, THPO, DHPS ALDH1A1 2644/4885
US-20240002423-A1 PROTECTED TETRASACCHARIDES, THEIR PROCESS OF PREPARATION AND THEIR USE AS TRANSGLUCOSYLASE ACCEPTOR SUBSTRATES IN THE CHEMO-ENZYMATIC SYNTHESIS OF SHIGELLA FLEXNERI SPECIFIC OLIGOSACCHARIDES SI, GALE, FUT5 ALDH1A1 1374/4885

“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.