SCHEMBL2107915

SCHEMBL2107915

O=C(O)CCCCCc1ccc2ccccc2c1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.87
HDAC1 Q13547 2/20 0.70
HDAC8 Q9BY41 2/20 0.70
MAPT P10636 1/20 0.66
RXFP1 Q9HBX9 1/20 0.66
CYP2D6 P10635 1/20 0.65
CYP2C19 P33261 1/20 0.65
HCAR2 Q8TDS4 1/20 0.59
NAAA Q02083 1/20 0.58
FFAR1 O14842 1/20 0.55
HDAC3 O15379 1/20 0.55
MAPK1 P28482 1/20 0.55
ADRA1A P35348 1/20 0.55
HDAC4 P56524 1/20 0.55
SLC6A3 Q01959 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HDAC7 Q8WUI4 1/20 0.55
HDAC2 Q92769 1/20 0.55
HDAC10 Q969S8 1/20 0.55
HDAC11 Q96DB2 1/20 0.55

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
SCHEMBL29866085 1.00 CYP1A2 (0.87) CYP1A2HDAC1HDAC8MAPTRXFP1
SCHEMBL31156411 1.00 CYP1A2 (0.87) CYP1A2HDAC1HDAC8MAPTRXFP1
SCHEMBL10439522 1.00 CYP1A2 (0.87) CYP1A2HDAC1HDAC8MAPTRXFP1
SCHEMBL710798 1.00 CYP1A2 (0.87) CYP1A2HDAC1HDAC8MAPTRXFP1
SCHEMBL10439619 1.00 CYP1A2 (0.87) CYP1A2HDAC1HDAC8MAPTRXFP1
SCHEMBL10439620 1.00 CYP1A2 (0.87) CYP1A2HDAC1HDAC8MAPTRXFP1
SCHEMBL10439755 1.00 CYP1A2 (0.87) CYP1A2HDAC1HDAC8MAPTRXFP1
SCHEMBL8434872 1.00 CYP1A2 (0.87) CYP1A2HDAC1HDAC8MAPTRXFP1
SCHEMBL2536989 1.00 CYP1A2 (0.87) CYP1A2HDAC1HDAC8MAPTRXFP1
SCHEMBL2545033 1.00 CYP1A2 (0.87) CYP1A2HDAC1HDAC8MAPTRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0254000-B1 RAPID DETECTION OF N. GONORRHOEAE WITHOUT CULTURE MILES INC. (US) 1991-05-22 EP claimed
CN-121801626-A High-pressure-resistant lubricating sealing grease composition and high-pressure-resistant lubricating sealing grease 金鹰润滑材料(金湖)有限公司 2026-04-07 CN disclosed
EP-4294878-A1 COATING COMPOSITION COMPRISING A PIGMENT PASTE COMPRISING AN ORGANIC PIGMENT AND AN ARYL-MODIFIED BRANCHED REACTION PRODUCT BASF Coatings GmbH (DE) 2023-12-27 EP disclosed
WO-2022175076-A1 COATING COMPOSITION COMPRISING A PIGMENT PASTE COMPRISING AN ORGANIC PIGMENT AND AN ARYL-MODIFIED BRANCHED REACTION PRODUCT BASF COATINGS GMBH (DE) 2022-08-25 WO disclosed
US-20190106592-A1 HYPERBRANCHED POLYMERS FOR ORGANIC PIGMENT DISPERSIONS AND WATER-SENSITIVE PIGMENTS BASF COATINGS GMBH (DE) 2019-04-11 US disclosed
EP-1865049-B1 CLEANING AGENT FOR THERMOSTATIC CHAMBERS WAKO PURE CHEM IND LTD (JP) 2014-08-06 EP disclosed
US-8669375-B2 Process for producing ester compound WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2014-03-11 US disclosed
US-20130066070-A1 PROCESS FOR PRODUCING ESTER COMPOUND WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2013-03-14 US disclosed
US-8318964-B2 Process for producing ester compound WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2012-11-27 US disclosed
US-20120288796-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-11-15 US disclosed
CN-1622943-A Heterocyclic onium salt WAKO PURE CHEM IND LTD (JP) 2005-06-01 CN disclosed
CN-1578766-A Hybrid onium salt WAKO PURE CHEM IND LTD (JP) 2005-02-09 CN disclosed
US-20050020710-A1 Hybrid onium salt WAKO PURE CHEMICALS INDUSTRIES, LTD. (JP) 2005-01-27 US disclosed
EP-1481973-A1 HETEROCYCLE-BEARING ONIUM SALTS Wako Pure Chemical Industries, Ltd. (JP) 2004-12-01 EP disclosed
EP-1443042-A1 HYBRID ONIUM SALT Wako Pure Chemical Industries, Ltd. (JP) 2004-08-04 EP disclosed
US-6723483-B1 Sulfonium salt compounds WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2004-04-20 US disclosed
EP-1238969-A2 Sulfonium salt compounds Wako Pure Chemical Industries, Ltd. (JP) 2002-09-11 EP disclosed
CN-1302799-A Sulfonium salt compound WAKO PURE CHEM IND LTD (JP) 2001-07-11 CN disclosed
EP-1113005-A1 Sulfonium salt compounds Wako Pure Chemical Industries, Ltd. (JP) 2001-07-04 EP disclosed
EP-0382990-A1 Strains of bacillus thuringiensis PLANT GENETIC SYSTEMS, N.V. (BE) 1990-08-22 EP 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-20130066070-A1 PROCESS FOR PRODUCING ESTER COMPOUND ADH1C, ADH5, ADH1A CYP1A2 440/4885HDAC1 1470/4885HDAC8 1767/4885
US-20190106592-A1 HYPERBRANCHED POLYMERS FOR ORGANIC PIGMENT DISPERSIONS AND WATER-SENSITIVE PIGMENTS TYR, PAH, AHR CYP1A2 81/4885HDAC1 4280/4885HDAC8 3579/4885

“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.