SCHEMBL1543632

SCHEMBL1543632

O=C(O)C1CC(O)CC(C(=O)O)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.41
GABRR1 P24046 1/20 0.41
CYP2D6 P10635 3/20 0.39
CYP1A2 P05177 3/20 0.39
ALOX15 P16050 3/20 0.39
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
ACE P12821 1/20 0.38
TSHR P16473 2/20 0.38
PMP22 Q01453 2/20 0.38
APLNR P35414 1/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 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
SCHEMBL2670495 1.00 CYP2C19 (0.41) CYP2C19GABRR1CYP2D6CYP1A2ALOX15
SCHEMBL871716 0.97
SCHEMBL9081638 0.97
SCHEMBL913504 0.97
SCHEMBL3490626 0.94 CYP2C19 (0.41) CYP2C19GABRR1CYP2D6CYP1A2ALOX15
SCHEMBL1543362 0.94 CYP2C19 (0.41) CYP2C19GABRR1CYP2D6CYP1A2ALOX15
SCHEMBL3490629 0.94 CYP2C19 (0.41) CYP2C19GABRR1CYP2D6CYP1A2ALOX15
SCHEMBL19295530 0.94 CYP2C19 (0.41) CYP2C19GABRR1CYP2D6CYP1A2ALOX15
SCHEMBL13913146 0.87 ATM (0.36) CYP2C19GABRR1CYP2D6CYP1A2ALOX15
SCHEMBL23366184 0.87 CYP2C19 (0.50) CYP2C19GABRR1CYP2D6CYP1A2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2492328-B1 THERMALLY REMOVABLE PRESSURE-SENSITIVE ADHESIVE SHEET NITTO DENKO CORP (JP) 2017-09-06 EP disclosed
US-20160347709-A1 ACID GENERATOR COMPOUNDS AND PHOTORESISTS COMPRISING SAME ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2016-12-01 US disclosed
US-20160347709-A1 ACID GENERATOR COMPOUNDS AND PHOTORESISTS COMPRISING SAME ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2016-12-01 US disclosed
EP-2311896-B1 POLYESTERS, POLYESTER COMPOSITIONS, ADHESIVE COMPOSITIONS, ADHESIVE LAYERS AND ADHESIVE SHEETS NITTO DENKO CORP (JP) 2016-10-05 EP disclosed
US-9096782-B2 Polyesters, polyester compositions, pressure-sensitive adhesive compositions, pressure-sensitive adhesive layers and pressure-sensitive adhesive sheets NITTO DENKO CORPORATION (JP) 2015-08-04 US disclosed
US-8999503-B2 Thermally removable pressure-sensitive adhesive sheet NITTO DENKO CORPORATION (JP) 2015-04-07 US disclosed
EP-2492326-B1 RADIATION-CURE REMOVAL TYPE PRESSURE-SENSITIVE ADHESIVE SHEET NITTO DENKO CORP (JP) 2015-02-25 EP disclosed
US-8962136-B2 Pressure-sensitive adhesive sheet for surface protection NITTO DENKO CORPORATION (JP) 2015-02-24 US disclosed
US-8889255-B2 Radiation-cure removal type pressure-sensitive adhesive sheet NITTO DENKO CORPORATION (JP) 2014-11-18 US disclosed
EP-2492328-A1 THERMALLY REMOVABLE PRESSURE-SENSITIVE ADHESIVE SHEET Nitto Denko Corporation (JP) 2012-08-29 EP disclosed
US-20110135924-A1 POLYESTERS, POLYESTER COMPOSITIONS, PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS, PRESSURE-SENSITIVE ADHESIVE LAYERS AND PRESSURE-SENSITIVE ADHESIVE SHEETS NITTO DENKO CORPORATION (JP) 2011-06-09 US disclosed
EP-2311896-A1 POLYESTERS, POLYESTER COMPOSITIONS, ADHESIVE COMPOSITIONS, ADHESIVE LAYERS AND ADHESIVE SHEETS Nitto Denko Corporation (JP) 2011-04-20 EP disclosed
EP-1858857-B1 AZABICYCLOALKANE DERIVATIVES USEFUL AS NICOTINIC ACETYLCHOLINE RECEPTOR AGONISTS LILLY CO ELI (US) 2010-12-08 EP disclosed
US-20100063204-A1 HYPER-BRANCHED POLYMER OF AN ESTER TYPE, AS WELL AS A TONER FOR ELECTROPHOTOGRAPHY AND A PIGMENT MASTER BATCH USING THE SAME TOYO BOSEKI KABUSHIKI KAISHA (JP) 2010-03-11 US disclosed
US-20100040967-A1 HYPER-BRANCHED POLYMER OF AN ESTER TYPE, AND A TONER FOR ELECTROPHOTOGRAPHY USING THE SAME TOYO BOSEKI KABUSHIKI KAISHA (JP) 2010-02-18 US disclosed
EP-2085418-A1 HYPERBRANCHED ESTER POLYMER, AND ELECTROPHOTOGRAPHIC TONER AND PIGMENT MASTER BATCH USING THE POLYMER Toyo Boseki Kabushiki Kaisha (JP) 2009-08-05 EP disclosed
EP-2083034-A1 ESTER-TYPE HYPERBRANCH POLYMER AND TONER FOR ELECTROPHOTOGRAPHY USING THE SAME Toyo Boseki Kabushiki Kaisha (JP) 2009-07-29 EP disclosed
US-20080261999-A1 Azabicycloalkane Derivatives Useful as Nicotinic Acetylcholine Receptor Agonists ELI LILLY AND COMPANY 2008-10-23 US disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 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 (2 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-20160347709-A1 ACID GENERATOR COMPOUNDS AND PHOTORESISTS COMPRISING SAME HAO2, PHGDH, PAH CYP2C19 568/4885GABRR1 1993/4885CYP2D6 1176/4885
US-20080261999-A1 Azabicycloalkane Derivatives Useful as Nicotinic Acetylcholine Receptor Agonists CHRNA1, CHRNA7, CHRNB1 CYP2C19 966/4885GABRR1 199/4885CYP2D6 1427/4885

“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.