SCHEMBL3742453

SCHEMBL3742453

CN(C)c1ccc(C=C2CCCCC2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 1.00
NPC1 O15118 2/20 1.00
RAB9A P51151 2/20 1.00
SMN1; SMN2 Q16637 2/20 1.00
HPGD P15428 1/20 1.00
CYP1A2 P05177 2/20 0.73
ALDH1A1 P00352 3/20 0.65
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
LMNA P02545 2/20 0.65
AKR1C3 P42330 1/20 0.57
AKR1C1 Q04828 1/20 0.57
HTT P42858 1/20 0.56
EGFR P00533 2/20 0.56
MAPK1 P28482 1/20 0.55
MCOLN3 Q8TDD5 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
NSD2 O96028 1/20 0.54
MAOB P27338 3/20 0.50
MAOA P21397 2/20 0.50

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
SCHEMBL4576499 1.00 MAPT (1.00) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL3738691 0.97 MAPT (0.93) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL10021997 0.97 MAPT (0.93) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL10621315 0.97 MAPT (0.93) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL28009938 0.84 MAPT (0.72) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL28009927 0.84 MAPT (0.72) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL815091 0.84 CYP1A2 (1.00) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL815092 0.84 CYP1A2 (1.00) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL19474922 0.84 CYP1A2 (1.00) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL28010604 0.82 MAPT (0.68) MAPTNPC1RAB9ASMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778176-B1 COMPOSITION FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO KGAA (DE) 2012-07-25 EP claimed
US-7413579-B2 Method for dyeing fibers containing keratin HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-08-19 US claimed
US-7300472-B2 Agents for coloring fibers containing keratin HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-11-27 US claimed
EP-1780747-A2 A conductive electrode powder, a method for preparing the same, and uses thereof Samsung SDI Co., Ltd. (KR) 2007-05-02 EP claimed
CN-1941218-A A conductive electrode powder, a method for preparing the same, preparing method of electrode of plasma display and plasma display SAMSUNG SDI CO LTD (KR) 2007-04-04 CN claimed
US-20070000074-A1 Agents for coloring fibers containing keratin HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2007-01-04 US claimed
EP-1534227-B1 AGENTS USED FOR DYEING KERATINOUS FIBERS HENKEL KGAA (DE) 2006-12-27 EP claimed
US-20060265818-A1 At least two oxidation dye precursors, at least one of which must be of the developer type or at least two oxo dye precursors, at least one of which must be a reactive carbonyl compound; hair dyes producing uniform and natural-looking, lightened color reflections HENKEL KOMMANDITGESELLSCHAFT AUF AKLLEN (HENKEL KGAA) (DE) 2006-11-30 US claimed
EP-1433469-B1 Composition for dyeing keratinous fibres HENKEL KGAA (DE) 2006-10-11 EP claimed
US-7105032-B2 Agents used for dyeing keratinous fibers HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2006-09-12 US claimed
EP-1434557-B1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS HENKEL KGAA (DE) 2005-11-09 EP claimed
EP-1575539-A1 DYE TABLETS Henkel Kommanditgesellschaft auf Aktien (DE) 2005-09-21 EP claimed
US-20050144740-A1 Agents used for dyeing keratinous fibers HENKEL AG & CO. KGAA (DE) 2005-07-07 US claimed
WO-2004058202-A1 DYE TABLETS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2004-07-15 WO claimed
EP-0873743-A2 Use of benzylidene-ketones for dyeing keratinous fibers Henkel Kommanditgesellschaft auf Aktien (DE) 1998-10-28 EP claimed
US-4367280-A AROMATIC CARBONYL COMPOUND AND P-DIALKYLAMINO AROMATIC CARBONYL COMPOUND COMBINATION POLYMERIZATION INITIATOR FUJI PHOTO FILM CO., LTD. (JP) 1983-01-04 US claimed
CN-113825809-B Printing ink, method for producing printed matter using same, and printed matter 东丽株式会社 2024-05-31 CN disclosed
CN-113825810-B Active energy ray-curable lithographic ink and method for producing printed matter using same 东丽株式会社 2023-12-01 CN disclosed
US-4367280-A AROMATIC CARBONYL COMPOUND AND P-DIALKYLAMINO AROMATIC CARBONYL COMPOUND COMBINATION POLYMERIZATION INITIATOR FUJI PHOTO FILM CO., LTD. (JP) 1983-01-04 US disclosed
US-4264710-A AN ETHYLENICALLY UNSATURATED COMPOUND, AND A PHOTOPOLYMERIZATION INIATOR FUJI PHOTO FILM CO., LTD. (JP) 1981-04-28 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 (3 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-20050144740-A1 Agents used for dyeing keratinous fibers KRT18, TUBB3, DSG1 MAPT 259/4885NPC1 4556/4885RAB9A 4292/4885
US-20060265818-A1 At least two oxidation dye precursors, at least one of which must be of the developer type or at least two oxo dye precursors, at least one of which must be a reactive carbonyl compound; hair dyes producing uniform and natural-looking, lightened color reflections KRT18, CUTA, PLOD2 MAPT 821/4885NPC1 3324/4885RAB9A 4273/4885
US-20070000074-A1 Agents for coloring fibers containing keratin KRT18, COL1A1, CYC1 MAPT 2036/4885NPC1 3147/4885RAB9A 3250/4885

“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.