SCHEMBL5143673

SCHEMBL5143673

COc1oc2ccccc2c1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.53
ALDH1A1 P00352 4/20 0.50
GAA P10253 3/20 0.50
NPC1 O15118 5/20 0.49
MAPT P10636 5/20 0.49
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
RAB9A P51151 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HPGD P15428 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
AHR P35869 1/20 0.45
CYP2C9 P11712 5/20 0.44
MGAM O43451 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
GMNN O75496 1/20 0.43
RAF1 P04049 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL18920885 0.78 CYP2C9 (0.45) KDM4EALDH1A1NPC1MAPTKMT2A
SCHEMBL120954 0.78 CA12 (0.51) KDM4EALDH1A1NPC1MAPTKMT2A
SCHEMBL31297525 0.78 CA12 (0.51) KDM4EALDH1A1NPC1MAPTKMT2A
SCHEMBL13617189 0.77 KDM4E (0.47) KDM4EALDH1A1GAANPC1MAPT
SCHEMBL13562292 0.76 CYP2C9 (0.44) KDM4EALDH1A1NPC1MAPTKMT2A
SCHEMBL7346302 0.74 GAA (0.62) KDM4EALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL17994122 0.72 KDM4E (0.55) KDM4EALDH1A1GAANPC1MAPT
SCHEMBL9524554 0.72 ABCG2 (0.66) KDM4EALDH1A1NPC1MAPTKMT2A
SCHEMBL2349072 0.72 KDM4E (0.59) KDM4EALDH1A1GAANPC1MAPT
SCHEMBL3537107 0.71 CYP2C9 (0.50) KDM4ENPC1KMT2AMEN1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040261198-A1 Restructuring and finishing of keratin fibers HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2004-12-30 US claimed
EP-1455736-A1 RESTRUCTURING AND FINISHING OF KERATIN FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2004-09-15 EP claimed
WO-2003053375-A1 RESTRUCTURING AND FINISHING OF KERATIN FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-07-03 WO claimed
US-7161010-B2 Methine dyes; coloring compound FUJI PHOTO FILM CO., LTD. (JP) 2007-01-09 US disclosed
US-20070004923-A1 Methine compound and silver halide photographic material containing the same FUJI PHOTO FILM CO., LTD. 2007-01-04 US disclosed
EP-0953634-B1 COMPOSITION FOR TREATING POROUS ARTICLE, TREATMENT METHOD, AND USE THEREOF SDS BIOTECH CORP (JP) 2006-06-07 EP disclosed
US-20040261198-A1 Restructuring and finishing of keratin fibers HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2004-12-30 US disclosed
EP-1455736-A1 RESTRUCTURING AND FINISHING OF KERATIN FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2004-09-15 EP disclosed
US-20040063962-A1 Methine compound and silver halide photographic material containing the same FUJI PHOTO FILM CO., LTD. 2004-04-01 US disclosed
US-6667405-B2 Nitrogen containing heterocyclilc compound and quaternary salt compound which are raw material of the methine dye, useful as coloring agent, a light absorber, for an optical disc or marker for diagnosis FUJI PHOTO FILM CO., LTD. (JP) 2003-12-23 US disclosed
WO-2003053375-A1 RESTRUCTURING AND FINISHING OF KERATIN FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-07-03 WO disclosed
US-20030017565-A1 COMPOSITION AND METHOD FOR TREATING A POROUS ARTICLE AND USE THEREOF SDS BIOTECH K.K. (JP) 2003-01-23 US disclosed
US-20020076666-A1 Methine compound and silver halide photographic material containing the same FUJI PHOTO FILM CO., LTD. 2002-06-20 US disclosed
US-6333146-B1 METHINE DYE WHICH IS USEFUL AS A COLORING AGENT, A LIGHT ABSORBER, A DYE FOR AN OPTICAL DISC, SPECTRAL SENSITIZING DYES FOR A SILVER HALIDE PHOTOGRAPH, AN ELECTROPHOTOGRAPH AND A PHOTOELECTRIC CONVERSION DEVICE, OR A MARKER FOR DIAGNOSIS FUJI PHOTO FILM CO., LTD. (JP) 2001-12-25 US disclosed
EP-0953634-A1 COMPOSITION FOR TREATING POROUS ARTICLE, TREATMENT METHOD, AND USE THEREOF SHOWA DENKO KABUSHIKI KAISHA (JP) 1999-11-03 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 (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-20070004923-A1 Methine compound and silver halide photographic material containing the same PYM1, NPM1, METTL3 KDM4E 2044/4885ALDH1A1 172/4885GAA 3792/4885
US-20020076666-A1 Methine compound and silver halide photographic material containing the same PYM1, NPM1, METTL3 KDM4E 1595/4885ALDH1A1 264/4885GAA 3679/4885
US-20040063962-A1 Methine compound and silver halide photographic material containing the same PYM1, NPM1, METTL3 KDM4E 1635/4885ALDH1A1 269/4885GAA 3706/4885

“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.