Sugi Predict

Sugi Predict / Compounds / SCHEMBL6029656

SCHEMBL6029656

SCHEMBL6029656

Oc1ccc(CC=CF)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 4/20 0.46
▸ ESR2 Q92731 2/20 0.46
▸ IDO1 P14902 2/20 0.44
▸ ABAT P80404 1/20 0.42
▸ CA2 P00918 4/20 0.41
▸ TMEM97 Q5BJF2 1/20 0.40
▸ SIGMAR1 Q99720 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ HTR1A P08908 1/20 0.39
▸ ADRA2A P08913 1/20 0.39
▸ SLC6A2 P23975 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ HTR3A P46098 1/20 0.39
▸ BACE1 P56817 1/20 0.39
▸ TAAR1 Q96RJ0 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ BLM P54132 2/20 0.38
▸ KMT2A Q03164 2/20 0.38

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
SCHEMBL6029654 1.00 ESR1 (0.46) ESR1ESR2IDO1ABATCA2
SCHEMBL448421 0.85 ESR1 (0.55) ESR1ESR2IDO1ABATCA2
SCHEMBL448422 0.85 ESR1 (0.55) ESR1ESR2IDO1ABATCA2
SCHEMBL16902817 0.80 ESR1 (0.50) ESR1ESR2IDO1ABATCA2
SCHEMBL11306664 0.80 ESR1 (0.50) ESR1ESR2IDO1ABATCA2
SCHEMBL1805094 0.78 ESR1 (0.48) ESR1ESR2IDO1ABATCA2
SCHEMBL27614866 0.78 ESR1 (0.48) ESR1ESR2IDO1ABATCA2
SCHEMBL16902821 0.78 ESR1 (0.48) ESR1ESR2IDO1ABATCA2
SCHEMBL156250 0.76 MAOB (0.71) ESR1ESR2IDO1CA2SLC6A2
SCHEMBL111719 0.76 IDO1 (0.50) ESR1ESR2IDO1ABATCA2

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 64 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-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
US-20030110579-A1 Method for colouring hair THE PROCTER & GAMBLE COMPANY (US) 2003-06-19 — — US 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-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-1998027942-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-07-02 — — WO disclosed
WO-1997024105-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
WO-1997024106-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-07-10 — — WO disclosed
WO-1997024107-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-07-10 — — WO disclosed
US-3957424-A Enzyme-activated oxidative process for coloring hair THE PROCTER & GAMBLE COMPANY (US) 1976-05-18 — — 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-20030110579-A1 Method for colouring hair COX5B, SHH, DNMT3A ESR1 3138/4885ESR2 1591/4885IDO1 482/4885
US-20030219399-A1 Hair conditioning compositions and their use in hair colouring compositions CD99, HLA-C, PLOD1 ESR1 4069/4885ESR2 4236/4885IDO1 112/4885
US-20040158941-A1 Hair colouring and conditioning compositions FNIP1, CUTA, SHH ESR1 4477/4885ESR2 4315/4885IDO1 304/4885
US-20040158938-A1 Method for colouring hair COX5B, SHH, DNMT3A ESR1 3138/4885ESR2 1591/4885IDO1 482/4885

“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.