SCHEMBL3582220

SCHEMBL3582220

CCc1cc(Br)c2c(c1N)C(=O)c1ccccc1C2=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 2/20 0.60
ALDH1A1 P00352 5/20 0.51
MAPT P10636 5/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
POLB P06746 2/20 0.51
HTT P42858 1/20 0.51
CYP1A1 P04798 1/20 0.46
CYP1A2 P05177 1/20 0.46
P2RY4 P51582 4/20 0.46
P2RY2 P41231 2/20 0.46
ADORA2A P29274 3/20 0.43
MAOA P21397 2/20 0.43
FGR P09769 1/20 0.43
PIM1 P11309 1/20 0.43
CSNK1A1 P48729 1/20 0.43
CSNK1D P48730 1/20 0.43
DYRK1A Q13627 1/20 0.43
HIPK2 Q9H2X6 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
SCHEMBL12593738 0.82 CYP1A1 (0.55) FTOALDH1A1MAPTMEN1KMT2A
1-Amino-2,4-Dibromoanthra-Quinone SCHEMBL3272427 0.81 FTO (0.64) FTOALDH1A1MAPTMEN1KMT2A
SCHEMBL11327828 0.81 AURKA (0.56) FTOALDH1A1MAPTMEN1KMT2A
SCHEMBL726339 0.80 CYP1A1 (0.66) FTOALDH1A1MAPTMEN1KMT2A
SCHEMBL27918992 0.80 MAPT (0.62) FTOALDH1A1MAPTMEN1KMT2A
SCHEMBL11179996 0.79 FTO (0.71) FTOALDH1A1MAPTMEN1KMT2A
SCHEMBL11510404 0.77 MAPK1 (0.53) FTOALDH1A1MAPTMEN1KMT2A
SCHEMBL10435103 0.77 FTO (0.59) FTOALDH1A1MAPTMEN1KMT2A
SCHEMBL11180975 0.77 FTO (0.59) FTOALDH1A1MAPTMEN1KMT2A
SCHEMBL11179290 0.76 FTO (0.55) FTOALDH1A1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101379144-B Dye and hair dyeing composition DYSTAR TEXTILFARBEN GMBH & CO 2012-08-22 CN disclosed
US-7776106-B2 Dyestuffs and hair dye compositions DYSTAR TEXTILFARBEN GMBH & CO., DEUTSCHLAND KG (DE) 2010-08-17 US disclosed
US-20090217466-A1 DYESTUFFS AND HAIR DYE COMPOSITIONS DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2009-09-03 US disclosed
CN-101379144-A Dye and hair dyeing composition DYSTAR TEXTILFARBEN GMBH & CO (DE) 2009-03-04 CN disclosed
EP-1984458-A2 DYESTUFFS AND HAIR DYE COMPOSITIONS DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2008-10-29 EP disclosed
WO-2007090799-A2 DYESTUFFS AND HAIR DYE COMPOSITIONS DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2007-08-16 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-20090217466-A1 DYESTUFFS AND HAIR DYE COMPOSITIONS TYR, CDY1; CDY1B, RDX FTO 290/4885ALDH1A1 44/4885MAPT 1579/4885

“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.