Sugi Predict

Sugi Predict / Compounds / SCHEMBL6030658

SCHEMBL6030658

SCHEMBL6030658

O=[N+]([O-])c1ccccc1-c1cc(O)ccc1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.51
▸ HPGD P15428 5/20 0.51
▸ MEN1 O00255 4/20 0.51
▸ ALDH1A1 P00352 3/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ TDP1 Q9NUW8 2/20 0.50
▸ MAPT P10636 5/20 0.49
▸ CASP6 P55212 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ APEX1 P27695 1/20 0.49
▸ MAPK1 P28482 4/20 0.48
▸ LMNA P02545 1/20 0.48
▸ CTSB P07858 1/20 0.47
▸ CHEK1 O14757 1/20 0.47
▸ WEE1 P30291 1/20 0.47
▸ PSMD14 O00487 1/20 0.46
▸ PRKACA P17612 1/20 0.46
▸ GPR35 Q9HC97 3/20 0.46
▸ GAA P10253 2/20 0.45

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
SCHEMBL6067942 0.88 ALDH1A1 (0.52) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2
SCHEMBL5707256 0.83 ALDH1A1 (0.59) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2
SCHEMBL6573424 0.83 MAPK1 (0.62) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2
SCHEMBL28160051 0.80 MAPT (0.46) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2
SCHEMBL30535903 0.79 ALDH1A1 (0.74) KMT2AHPGDMEN1ALDH1A1RAB9A
SCHEMBL1287837 0.79 ALDH1A1 (0.74) KMT2AHPGDMEN1ALDH1A1RAB9A
SCHEMBL18347015 0.78 ALDH1A1 (0.53) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2
SCHEMBL1423631 0.77 CDC7 (0.50) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2
SCHEMBL13603461 0.77 MEN1 (0.64) KMT2AMEN1ALDH1A1RAB9ATDP1
SCHEMBL30987815 0.77 ALDH1A1 (0.71) KMT2AHPGDMEN1ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6986886-B2 Hair conditioning compositions and their use in hair coloring compositions THE PROCTER & GAMBLE COMPANY (US) 2006-01-17 — — US disclosed
US-20040158941-A1 Hair colouring and conditioning compositions THE PROCTER & GAMBLE COMPANY (US) 2004-08-19 — — US disclosed
US-20040158938-A1 Method for colouring hair THE PROCTER & GAMBLE COMPANY 2004-08-19 — — US disclosed
US-6758866-B2 AQUEOUS SOLUTION OF CHELATE COMPOUND, OXIDATION COLOR DYE AND COUPLER UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2004-07-06 — — US disclosed
US-6695888-B2 COMPLEX TRANSITION METAL HAIR DYE UNILEVER HOME & PERSONAL CARE, USA, DIVISION OF CONOPCO, INC. 2004-02-24 — — US disclosed
WO-2004014328-A1 ONE STEP HAIR COLORING COMPOSITIONS COMPRISING WATER SOLUBLE CARBONATE RELEASING SALTS UNILEVER PLC (GB) 2004-02-19 — — WO disclosed
US-20040019980-A1 One step hair coloring compositions using salts UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2004-02-05 — — US disclosed
US-20030219399-A1 Hair conditioning compositions and their use in hair colouring compositions THE PROCTER & GAMBLE COMPANY (US) 2003-11-27 — — US disclosed
EP-1341502-A2 HAIR CONDITIONING COMPOSITIONS AND THEIR USE IN HAIR COLOURING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2003-09-10 — — EP disclosed
EP-0876134-B1 HAIR COLORING COMPOSITIONS PROCTER & GAMBLE (US) 2003-09-03 — — EP disclosed
EP-0869769-A1 HAIR BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-10-14 — — EP disclosed
WO-1998027943-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-07-02 — — WO disclosed
WO-1998027944-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-07-02 — — WO disclosed
WO-1998027942-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-07-02 — — WO disclosed
WO-1998027941-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-07-02 — — WO disclosed
WO-1998027945-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-07-02 — — WO disclosed
WO-1997024107-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-07-10 — — WO disclosed
WO-1997024105-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-07-10 — — WO disclosed
WO-1997024106-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-07-10 — — WO disclosed
WO-1997024108-A1 HAIR BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-07-10 — — 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 (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-20030219399-A1 Hair conditioning compositions and their use in hair colouring compositions CD99, HLA-C, PLOD1 KMT2A 219/4885HPGD 3782/4885MEN1 3952/4885
US-20040158941-A1 Hair colouring and conditioning compositions FNIP1, CUTA, SHH KMT2A 1675/4885HPGD 2400/4885MEN1 953/4885
US-20040158938-A1 Method for colouring hair COX5B, SHH, DNMT3A KMT2A 1882/4885HPGD 2102/4885MEN1 2883/4885

“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.