SCHEMBL2532490

SCHEMBL2532490

CN(C)CCCN(C)c1ccccc1C=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 5/20 0.39
TSHR P16473 2/20 0.39
HTR2A P28223 3/20 0.38
HRH1 P35367 3/20 0.38
SIGMAR1 Q99720 2/20 0.38
PIM1 P11309 1/20 0.37
PIM3 Q86V86 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 3/20 0.36
CYP2D6 P10635 3/20 0.36
MAPT P10636 3/20 0.36
SLC22A1 O15245 2/20 0.36

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
SCHEMBL2425306 0.89 MEN1 (0.44) LMNAKMT2AMEN1THRBBLM
SCHEMBL7293971 0.86 TDP1 (0.41) LMNAKMT2AMEN1THRBBLM
SCHEMBL12201233 0.85 MEN1 (0.35) LMNAKMT2AMEN1THRBBLM
SCHEMBL12451598 0.81 MEN1 (0.38) LMNAKMT2AMEN1THRBBLM
SCHEMBL9157004 0.81 MEN1 (0.38) LMNAKMT2AMEN1THRBBLM
SCHEMBL7544897 0.80 FFAR4 (0.41) LMNAKMT2AMEN1THRBBLM
SCHEMBL14521051 0.80 MEN1 (0.43) LMNAKMT2AMEN1THRBBLM
SCHEMBL5546790 0.79 HDAC2 (0.40) SMN1; SMN2MAPTADRA1ASLC6A3NPSR1
SCHEMBL8358331 0.79 TAAR1 (0.49) SIGMAR1
SCHEMBL13881255 0.79 MEN1 (0.32) LMNAKMT2AMEN1THRBBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8038732-B2 Fluorescent entity, dyeing composition containing at least one fluorescent entity, and method for lightening keratin materials using said at least one fluorescent entity L'OREAL S.A. (FR) 2011-10-18 US disclosed
EP-2205681-B1 DYE COMPOSITION COMPRISING AT LEAST ONE COLORLESS DISULFIDE/THIOL PRECURSOR, AND DYEING PROCESS USING THE COMPOSITION OREAL (FR) 2011-08-31 EP disclosed
US-20100287714-A1 DYE COMPOSITION CONTAINING A THIOL/DISULPHIDE FLUORESCENT DYE COMPRISING AMINO GROUPS AND COMPRISING AN INTERNAL CATIONIC CHARGE, PROCESS FOR LIGHTENING KERATIN MATERIALS USING THIS DYE L'ORÉAL (FR) 2010-11-18 US disclosed
WO-2009037348-A1 INDOLINIUM-DERIVED THIOL/DISULFIDE DYE, DYE COMPOSITION COMPRISNG THIS DYE, PROCESS FOR LIGHTENING KERATIN MATERIALS USING THIS DYE L'OREAL (FR) 2009-03-26 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 (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-20100287714-A1 DYE COMPOSITION CONTAINING A THIOL/DISULPHIDE FLUORESCENT DYE COMPRISING AMINO GROUPS AND COMPRISING AN INTERNAL CATIONIC CHARGE, PROCESS FOR LIGHTENING KERATIN MATERIALS USING THIS DYE KRT18, DSG1, KRTCAP2 LMNA 1650/4885KMT2A 2283/4885MEN1 4121/4885

“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.