SCHEMBL4616232

SCHEMBL4616232

CCOC(=O)Cn1c(=O)sc2ccccc21

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.67
ALDH1A1 P00352 3/20 0.64
L3MBTL1 Q9Y468 3/20 0.62
NPSR1 Q6W5P4 2/20 0.58
TP53 P04637 2/20 0.58
RECQL P46063 1/20 0.58
GAA P10253 2/20 0.57
KDM4E B2RXH2 3/20 0.57
TSHR P16473 1/20 0.56
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MAPT P10636 2/20 0.54
HTT P42858 1/20 0.54
MEN1 O00255 1/20 0.53
MITF O75030 1/20 0.53
KMT2A Q03164 1/20 0.53

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
SCHEMBL11741940 0.87 MEN1 (0.67) TDP1ALDH1A1L3MBTL1NPSR1TP53
SCHEMBL11740900 0.85 L3MBTL1 (0.65) TDP1ALDH1A1L3MBTL1NPSR1TP53
SCHEMBL962371 0.84 ALDH1A1 (0.58) TDP1ALDH1A1NPSR1TP53RECQL
SCHEMBL11088115 0.84 ALDH1A1 (0.58) TDP1ALDH1A1NPSR1TP53RECQL
Bromide SCHEMBL962370 0.83 ALDH1A1 (0.57) TDP1ALDH1A1NPSR1TP53RECQL
SCHEMBL11539837 0.83 L3MBTL1 (0.56) TDP1ALDH1A1L3MBTL1NPSR1TP53
SCHEMBL30686946 0.82 L3MBTL1 (0.72) TDP1ALDH1A1L3MBTL1NPSR1TP53
SCHEMBL11104613 0.81 ALDH1A1 (0.49) TDP1ALDH1A1L3MBTL1NPSR1TP53
SCHEMBL11103716 0.81 ALDH1A1 (0.49) TDP1ALDH1A1L3MBTL1NPSR1TP53
SCHEMBL8892411 0.81 ALDH1A1 (0.48) TDP1ALDH1A1L3MBTL1NPSR1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7429274-B2 Agent and method for the oxidative coloring of keratin fibers WELLA AG (DE) 2008-09-30 US claimed
EP-1601335-B1 MEANS AND METHOD FOR THE SIMULTANEOUS BLEACHING AND DYEING OF KERATIN FIBRES WELLA AG (DE) 2008-03-19 EP claimed
EP-1699427-B1 AGENT AND METHOD FOR OXIDATIVELY DYING KERATIN FIBERS WELLA AG (DE) 2008-02-27 EP claimed
US-7326254-B2 Means and method for the simultaneous bleaching and dyeing of keratin fibres WELLA AG (DE) 2008-02-05 US claimed
US-7291183-B2 Agent and method for dyeing keratin fibers WELLA AG (DE) 2007-11-06 US claimed
US-7244278-B2 Agent and method for oxidative coloring of keratin fibers WELLA AG (DE) 2007-07-17 US claimed
US-20070079452-A1 Agent and method for the oxidative coloring of keratin fibers Wella GmbH (DE) 2007-04-12 US claimed
US-20070067927-A1 Agent and method for oxidative coloring of keratin fibers HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2007-03-29 US claimed
EP-1599179-B1 AGENT AND METHOD FOR DYEING KERATIN FIBRES WELLA AG (DE) 2006-10-11 EP claimed
US-20060162096-A1 Means and method for the simultaneous bleaching and dyeing of keratin fibres HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2006-07-27 US claimed
US-20060010616-A1 Agent and method for dyeing keratin fibers Wella GmbH (DE) 2006-01-19 US claimed
US-7429274-B2 Agent and method for the oxidative coloring of keratin fibers WELLA AG (DE) 2008-09-30 US disclosed
US-7326254-B2 Means and method for the simultaneous bleaching and dyeing of keratin fibres WELLA AG (DE) 2008-02-05 US disclosed
US-7291183-B2 Agent and method for dyeing keratin fibers WELLA AG (DE) 2007-11-06 US disclosed
US-7244278-B2 Agent and method for oxidative coloring of keratin fibers WELLA AG (DE) 2007-07-17 US disclosed
US-20070079452-A1 Agent and method for the oxidative coloring of keratin fibers Wella GmbH (DE) 2007-04-12 US disclosed
US-20070067927-A1 Agent and method for oxidative coloring of keratin fibers HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2007-03-29 US disclosed
US-20060162096-A1 Means and method for the simultaneous bleaching and dyeing of keratin fibres HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2006-07-27 US disclosed
US-20060010616-A1 Agent and method for dyeing keratin fibers Wella GmbH (DE) 2006-01-19 US disclosed
US-4049419-A SOYBEAN PLANTS MONSANTO COMPANY (US) 1977-09-20 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 (4 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-20060162096-A1 Means and method for the simultaneous bleaching and dyeing of keratin fibres KRT18, GPX4, NOX4 TDP1 3184/4885ALDH1A1 727/4885L3MBTL1 4866/4885
US-20070067927-A1 Agent and method for oxidative coloring of keratin fibers KRT18, KIT, AOC1 TDP1 3867/4885ALDH1A1 137/4885L3MBTL1 4883/4885
US-20070079452-A1 Agent and method for the oxidative coloring of keratin fibers KRT18, KIT, CKMT1A; CKMT1B TDP1 3245/4885ALDH1A1 129/4885L3MBTL1 4883/4885
US-20060010616-A1 Agent and method for dyeing keratin fibers KRT18, KIT, MKI67 TDP1 4220/4885ALDH1A1 561/4885L3MBTL1 4881/4885

“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.