SCHEMBL5585178

SCHEMBL5585178

O=C1CCCC(=C/c2ccccc2)/C1=C/c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.76
HTT P42858 2/20 0.76
CYP1A2 P05177 4/20 0.67
F3 P13726 2/20 0.67
MGAM O43451 3/20 0.56
GAA P10253 3/20 0.56
SI P14410 3/20 0.56
MGAM2 Q2M2H8 3/20 0.56
MAPT P10636 4/20 0.54
MIF P14174 1/20 0.54
AKR1C3 P42330 1/20 0.51
AKR1C1 Q04828 1/20 0.51
LMNA P02545 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
EGFR P00533 1/20 0.49
HPGD P15428 4/20 0.47
MAOB P27338 1/20 0.45
HSD11B1 P28845 2/20 0.44
CYP2C9 P11712 1/20 0.44

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
SCHEMBL2201906 1.00 ALDH1A1 (0.76) ALDH1A1HTTCYP1A2F3MGAM
SCHEMBL6851578 0.89 CYP1A2 (0.64) ALDH1A1HTTCYP1A2F3MGAM
SCHEMBL21539509 0.89 CYP1A2 (0.64) ALDH1A1HTTCYP1A2F3MGAM
SCHEMBL1414018 0.88 ALDH1A1 (0.68) ALDH1A1HTTCYP1A2F3MGAM
SCHEMBL812295 0.86 ALDH1A1 (1.00) ALDH1A1HTTCYP1A2F3MGAM
SCHEMBL1524525 0.86 ALDH1A1 (1.00) ALDH1A1HTTCYP1A2F3MGAM
SCHEMBL809531 0.86 ALDH1A1 (1.00) ALDH1A1HTTCYP1A2F3MGAM
SCHEMBL12272592 0.84 ALDH1A1 (0.62) ALDH1A1HTTCYP1A2F3MGAM
SCHEMBL979655 0.82 ALDH1A1 (0.92) ALDH1A1HTTCYP1A2F3MGAM
SCHEMBL10734311 0.82 ALDH1A1 (0.92) ALDH1A1HTTCYP1A2F3MGAM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0866110-B1 Light-emitting material for organo-electroluminescence device and organic electroluminescence device TOYO INK MFG CO (JP) 2004-10-20 EP claimed
US-5489623-A APPLYING POLYMER TO SURFACE, EXPOSING TO INCIDENT PHOTONICRADIATION TO RENDER PORTIONS LESS SOLUBLE OR DISPERSIBLE THE DOW CHEMICAL COMPANY (US) 1996-02-06 US claimed
EP-0676062-A1 PHOTODEFINABLE POLYMERS CONTAINING PERFLUOROCYCLOBUTANE GROUPS THE DOW CHEMICAL COMPANY (US) 1995-10-11 EP claimed
US-5426164-A Solvent and chemical resistant coatings and photoresists; photocuring of perfluorovinyl polymers containing photo active sites; cyclization THE DOW CHEMICAL COMPANY (US) 1995-06-20 US claimed
WO-1994015258-A1 PHOTODEFINABLE POLYMERS CONTAINING PERFLUOROCYCLOBUTANE GROUPS THE DOW CHEMICAL COMPANY (US) 1994-07-07 WO claimed
EP-1247797-B1 Cycloalkanone Derivates MERCK PATENT GMBH (DE) 2007-07-04 EP disclosed
US-6939479-B2 Cycloalkanone derivatives MERCK PATENT GMBH (DE) 2005-09-06 US disclosed
EP-0866110-B1 Light-emitting material for organo-electroluminescence device and organic electroluminescence device TOYO INK MFG CO (JP) 2004-10-20 EP disclosed
US-20030080321-A1 Cycloalkanone derivatives MERCK KGAA (DE) 2003-05-01 US disclosed
EP-1247797-A2 Cycloalkanone Derivates MERCK PATENT GmbH (DE) 2002-10-09 EP disclosed
US-20010033944-A1 LIGHT-EMITTING MATERIAL FOR ORGANO-ELECTROLUMINESCENCE DEVICE AND FOR ORGANIC ELECTROLUMINESCENCE DEVICE WHICH THE MATERIAL IS APPLIED TOYO INK MANUFACTURING CO., LTD. (JP) 2001-10-25 US disclosed
US-6280859-B1 AROMATIC ELECTROLUMINESCENT MATERIAL OR NONSUBSTITUTED HETEROAROMATIC GROUP OR DIVALENT GROUP TOYO INK MANUFACTURING CO., LTD. (JP) 2001-08-28 US disclosed
EP-0934992-A1 Light-emitting material for organo-electroluminescence device and organic electroluminescence device TOYO INK MANUFACTURING CO., LTD. (JP) 1999-08-11 EP disclosed
EP-0866110-A1 Light-emitting material for organo-electroluminescence device and organic electroluminescence device TOYO INK MANUFACTURING CO., LTD. (JP) 1998-09-23 EP disclosed
EP-0223373-B1 WATER-SOLUBLE PHOTOINITIATORS AUTOTYPE INTERNATIONAL LIMITED (GB) 1990-04-18 EP disclosed
US-4824765-A DIBENZALKETONES AUTOTYPE INTERNATIONAL LIMITED, A BRITISH CO. (GB) 1989-04-25 US disclosed
EP-0223373-A1 Water-soluble photoinitiators AUTOTYPE INTERNATIONAL LIMITED (GB) 1987-05-27 EP disclosed
US-4284705-A EXPOSURE, DEVELOPMENT, COATING EASTMAN KODAK COMPANY (US) 1981-08-18 US disclosed
US-4215041-A Diazo substituted amino-benzene salts and lithographic plate comprising same EASTMAN KODAK COMPANY (US) 1980-07-29 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 (1 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-20010033944-A1 LIGHT-EMITTING MATERIAL FOR ORGANO-ELECTROLUMINESCENCE DEVICE AND FOR ORGANIC ELECTROLUMINESCENCE DEVICE WHICH THE MATERIAL IS APPLIED L1CAM, ELP1, CRY1 ALDH1A1 52/4885HTT 2592/4885CYP1A2 1573/4885

“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.