SCHEMBL25585

SCHEMBL25585

c1ccc(CC2OCCCO2)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.40
GBA1 P04062 1/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
LTB4R Q15722 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
USP2 O75604 1/20 0.38
HPGD P15428 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
Methyl Alcohol SCHEMBL28286625 0.96 ALDH1A1 (0.39) ALDH1A1POLBGBA1RAB9ASMN1; SMN2
SCHEMBL448797 0.96 ALDH1A1 (0.41) ALDH1A1POLBGBA1RAB9ASMN1; SMN2
SCHEMBL1491164 0.94 ALDH1A1 (0.40) ALDH1A1POLBGBA1RAB9ASMN1; SMN2
SCHEMBL3950950 0.94 ALDH1A1 (0.40) ALDH1A1POLBGBA1RAB9ASMN1; SMN2
SCHEMBL22722 0.91 GBA1 (0.42) GBA1LTB4RLTB4R2
SCHEMBL5269537 0.82 GBA1 (0.42) GBA1
SCHEMBL7197655 0.80 TSHR (0.56) POLB
SCHEMBL1558896 0.79 LTB4R (0.44) GBA1LTB4RLTB4R2
SCHEMBL30754350 0.79 LTB4R (0.44) GBA1LTB4RLTB4R2
SCHEMBL1773236 0.79 MEN1 (0.41) ALDH1A1POLBRAB9ASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114830395-B Nonaqueous electrolyte secondary battery 松下知识产权经营株式会社 2025-02-11 CN claimed
CN-111116604-A Process method for preparing fluorescamine 苏州百灵威超精细材料有限公司 2020-05-08 CN claimed
US-20130102641-A1 PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2013-04-25 US claimed
US-7790708-B2 Prodrugs of GABA analogs, compositions and uses thereof XENOPORT, INC. (US) 2010-09-07 US claimed
US-20090105292-A9 Glucocorticoid Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-04-23 US claimed
EP-1902714-A1 Prodrugs of gaba analogs, compositions and uses thereof Xenoport, Inc. (US) 2008-03-26 EP claimed
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2007-12-06 US claimed
EP-1404324-B1 PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF XENOPORT INC (US) 2007-12-05 EP claimed
EP-1718653-A1 GLUCOCORTICOID RECEPTOR MODULATOR COMPOUNDS AND METHODS- UTILITY Ligand Pharmaceuticals Inc. (US) 2006-11-08 EP claimed
US-7060727-B2 Prodrugs of fused GABA analogs, pharmaceutical compositions and uses thereof XENOPORT, INC. (US) 2006-06-13 US claimed
WO-2005082909-A1 GLUCOCORTICOID RECEPTOR MODULATOR COMPOUNDS AND METHODS- UTILITY LIGAND PHARMACEUTICALS INCORPORATED (US) 2005-09-09 WO claimed
US-20040147455-A1 Prodrugs of fused GABA analogs, pharmaceutical compositions and uses thereof XENOPORT, INC. 2004-07-29 US claimed
WO-2004052360-A1 PRODRUGS OF FUSED GABA ANALOGS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2004-06-24 WO claimed
US-20030176398-A1 Prodrugs of GABA analogs, compositions and uses thereof HPS INVESTMENT PARTNERS, LLC, AS ADMINISTRATIVE AGENT 2003-09-18 US claimed
EP-0586394-A1 METHYL ESTERS OF ALDIMINO- OR KETIMINO-OXY-ORTHOTOLYLACRYLIC ACID, MANUFACTURING PROCESS AND FUNGICIDES CONTAINING THEM CIBA-GEIGY AG (CH) 1994-03-16 EP claimed
WO-1992018494-A1 METHYL ESTERS OF ALDIMINO- OR KETIMINO-OXY-ORTHOTOLYLACRYLIC ACID, MANUFACTURING PROCESS AND FUNGICIDES CONTAINING THEM CIBA-GEIGY AG (CH) 1992-10-29 WO claimed
EP-4665718-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF Apogee Pharmaceuticals, Inc. (CA) 2025-12-24 EP disclosed
US-12378231-B2 Small molecules as monoacylglycerol lipase (MAGL) inhibitors, compositions and use thereof APOGEE PHARMACEUTICALS, INC. (CA) 2025-08-05 US disclosed
EP-0132392-A2 Asymmetric synthesis of alpha-substituted-alpha-cyanomethyl alcohols ICI AUSTRALIA LIMITED (AU) 1985-01-30 EP disclosed
US-4000311-A Substituted 1,3-benzodioxane agents for the control of plant bacteria CIBA-GEIGY CORPORATION (US) 1976-12-28 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 (6 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-12378231-B2 Small molecules as monoacylglycerol lipase (MAGL) inhibitors, compositions and use thereof MGLL, PNLIP, LPL ALDH1A1 530/4885POLB 760/4885GBA1 53/4885
US-20130102641-A1 PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF GABRB1, GABRB2, GABRB3 ALDH1A1 298/4885POLB 3243/4885GBA1 398/4885
US-20090105292-A9 Glucocorticoid Receptor Modulator Compounds and Methods NR3C1, NR3C2, MC2R ALDH1A1 1465/4885POLB 3867/4885GBA1 1801/4885
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods NR3C1, NR3C2, MC2R ALDH1A1 1465/4885POLB 3867/4885GBA1 1801/4885
US-20030176398-A1 Prodrugs of GABA analogs, compositions and uses thereof GABRB1, GABRB2, GABRB3 ALDH1A1 298/4885POLB 3243/4885GBA1 398/4885
US-20040147455-A1 Prodrugs of fused GABA analogs, pharmaceutical compositions and uses thereof GABRB1, GABRB2, GABRB3 ALDH1A1 380/4885POLB 3280/4885GBA1 296/4885

“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.