SCHEMBL5162466

SCHEMBL5162466

COc1ccc(NCCO)cc1NCCO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.44
ALDH1A1 P00352 3/20 0.44
BCL6 P41182 1/20 0.43
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43
TUBA1A Q71U36 1/20 0.43
TUBA1C Q9BQE3 1/20 0.43
TUBB6 Q9BUF5 1/20 0.43
TUBB2B Q9BVA1 1/20 0.43
TUBB1 Q9H4B7 1/20 0.43
TNF P01375 1/20 0.42
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL22333905 0.90 APP (0.43) POLBALDH1A1BCL6TUBB4ATUBB
SCHEMBL8348474 0.86 KDM4E (0.51) POLBALDH1A1BCL6TNFKDM4E
SCHEMBL9125673 0.85 ALDH1A1 (0.50) POLBALDH1A1KDM4EL3MBTL1TSHR
SCHEMBL3878469 0.85 BACE1 (0.47) POLBALDH1A1KDM4ESMN1; SMN2KMT2A
SCHEMBL11144337 0.85 CASP3 (0.55) POLBALDH1A1KDM4EL3MBTL1GAA
SCHEMBL11822323 0.83 MAPT (0.58) POLBALDH1A1KDM4EL3MBTL1GAA
SCHEMBL12000685 0.83 ALDH1A1 (0.51) POLBALDH1A1BCL6TUBB4ATUBB
SCHEMBL3859668 0.83 TUBB4A (0.57) ALDH1A1BCL6TUBB4ATUBBTUBA3C
SCHEMBL28409276 0.83 RAD52 (0.55) POLBALDH1A1KDM4EGBA1L3MBTL1
SCHEMBL3904069 0.83 KDM4E (0.46) POLBALDH1A1TNFKDM4EGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0663814-A1 PROCESS FOR DYEING KERATIN FIBRES USING AN ACID PH ALCOXYMETEPHENYLENEDIAMINE AND COMPOSITIONS THEREFOR L'OREAL (FR) 1995-07-26 EP claimed
WO-1993010744-A2 PROCESS FOR DYEING KERATIN FIBRES USING AN ACID PH ALCOXYMETEPHENYLENEDIAMINE AND COMPOSITIONS THEREFOR L'OREAL (FR) 1993-06-10 WO claimed
US-5180396-A Process for dyeing keratinous fibres with oxidation dyes combined with indole derivatives and dyeing composition employed L'OREAL (FR) 1993-01-19 US claimed
US-5180397-A Hair dyes L'OREAL (FR) 1993-01-19 US claimed
US-4985955-A INTENSE COLORATIONS IN RELATIVELY SHORT TIMES L'OREAL (FR) 1991-01-22 US claimed
EP-1758545-A1 4,5,6-SUBSTITUTED M-PHENYLENE DIAMINE COUPLING COMPONENTS Henkel Kommanditgesellschaft auf Aktien (DE) 2007-03-07 EP disclosed
WO-2006050768-A1 NOVEL M-PHENYLENEDIAMINE COUPLER COMPOUNDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-05-18 WO disclosed
EP-1647266-A1 New coupler components Henkel Kommanditgesellschaft auf Aktien (DE) 2006-04-19 EP disclosed
US-20060016024-A1 Novel coupling components PARALLEL WIRELESS, INC. 2006-01-26 US disclosed
WO-2005117818-A1 4,5,6-SUBSTITUTED M-PHENYLENE DIAMINE COUPLING COMPONENTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-12-15 WO disclosed
EP-1583511-B1 NOVEL COUPLING COMPONENTS HENKEL KGAA (DE) 2005-11-09 EP disclosed
EP-0640334-B1 Hair coloring composition BRISTOL MYERS SQUIBB CO (US) 2001-12-12 EP disclosed
EP-0399746-B1 USE OF CHLORITES AS OXIDANTS IN HAIR COLORING Bristol-Myers Squibb Company (US) 1993-03-10 EP disclosed
US-5180396-A Process for dyeing keratinous fibres with oxidation dyes combined with indole derivatives and dyeing composition employed L'OREAL (FR) 1993-01-19 US disclosed
US-5180397-A Hair dyes L'OREAL (FR) 1993-01-19 US disclosed
EP-0507448-A2 Oxidative hair dyeing process with catalytic pretreatment Bristol-Myers Squibb Company (US) 1992-10-07 EP disclosed
US-5100436-A Transition metal complex of 2,2*-dipyridine or 1,10-phenanthroline deposited on hair, reduced time for coloring CLAIROL INCORPORATED (US) 1992-03-31 US disclosed
US-5032138-A Chlorites as oxidants in hair coloring CLAIROL INCORPORATED (US) 1991-07-16 US disclosed
US-4985955-A INTENSE COLORATIONS IN RELATIVELY SHORT TIMES L'OREAL (FR) 1991-01-22 US disclosed
EP-0399746-A1 Use of chlorites as oxidants in hair coloring Bristol-Myers Squibb Company (US) 1990-11-28 EP 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-20060016024-A1 Novel coupling components KRT18, H1-4, H1-3 POLB 1808/4885ALDH1A1 1969/4885BCL6 1597/4885

“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.