SCHEMBL6069201

SCHEMBL6069201

COc1ccc(N)cc1NCc1ccc(O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.48
MAPT P10636 5/20 0.47
KMT2A Q03164 5/20 0.47
MEN1 O00255 3/20 0.47
CRHBP P24387 2/20 0.47
CRHR2 Q13324 2/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 3/20 0.47
HPGD P15428 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PTPN7 P35236 1/20 0.46
DUSP3 P51452 1/20 0.46
GAA P10253 2/20 0.45
POLB P06746 2/20 0.45
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 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
SCHEMBL6069325 0.85 KMT2A (0.39) HDAC8MAPTKMT2AMEN1HDAC1
SCHEMBL6555026 0.85 HDAC8 (0.59) HDAC8MAPTKMT2AMEN1CRHBP
SCHEMBL6069254 0.85 MAPT (0.51) HDAC8MAPTKMT2AMEN1CRHBP
SCHEMBL6069135 0.82 MAPT (0.41) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL6069588 0.81 MAPT (0.40) MAPTKMT2AMEN1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL6069051 0.81 MAPT (0.40) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL11935889 0.79 HDAC8 (0.57) HDAC8MAPTKMT2AMEN1CRHBP
SCHEMBL6069558 0.77 CA12 (0.53) MAPTKMT2AMEN1CRHBPCRHR2
SCHEMBL6259279 0.77 TNIK (0.49) MAPTKMT2AMEN1CRHBPCRHR2
SCHEMBL6069436 0.77 ALDH1A1 (0.47) HDAC8MAPTKMT2AMEN1HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7074243-B2 N-benzyl-m-phenylenediamine derivatives and dyes containing said compounds WELLA AG (DE) 2006-07-11 US claimed
EP-1390341-A1 N-BENZYL-M-PHENYLENEDIAMINE DERIVATIVES AND DYES CONTAINING SAID COMPOUNDS Wella Aktiengesellschaft (DE) 2004-02-25 EP claimed
US-20030182735-A1 N-benzyl-m-phenylenediamine derivatives and dyes containing said compounds WELLA AKTIENGESELLSCHAFT (DE) 2003-10-02 US claimed
WO-2002096854-A1 N-BENZYL-M-PHENYLENEDIAMINE DERIVATIVES AND DYES CONTAINING SAID COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2002-12-05 WO claimed
US-7074243-B2 N-benzyl-m-phenylenediamine derivatives and dyes containing said compounds WELLA AG (DE) 2006-07-11 US disclosed
EP-1390341-A1 N-BENZYL-M-PHENYLENEDIAMINE DERIVATIVES AND DYES CONTAINING SAID COMPOUNDS Wella Aktiengesellschaft (DE) 2004-02-25 EP disclosed
US-20030182735-A1 N-benzyl-m-phenylenediamine derivatives and dyes containing said compounds WELLA AKTIENGESELLSCHAFT (DE) 2003-10-02 US disclosed
WO-2002096854-A1 N-BENZYL-M-PHENYLENEDIAMINE DERIVATIVES AND DYES CONTAINING SAID COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2002-12-05 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-20030182735-A1 N-benzyl-m-phenylenediamine derivatives and dyes containing said compounds KRT18, VIM, KPNB1 HDAC8 3317/4885MAPT 469/4885KMT2A 2274/4885

“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.