SCHEMBL6654152

SCHEMBL6654152

CC1=NN(CCO)C(=O)C1=Cc1ccc(O)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
GAA P10253 3/20 0.53
MAPT P10636 2/20 0.53
L3MBTL1 Q9Y468 4/20 0.48
KDM4E B2RXH2 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ALPL P05186 1/20 0.48
ALPI P09923 1/20 0.48
ALPG P10696 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
EP300 Q09472 2/20 0.44
SIRT5 Q9NXA8 2/20 0.43
AKR1B1 P15121 2/20 0.41
KAT8 Q9H7Z6 1/20 0.40
AMY1A P0DUB6 1/20 0.40
ATM Q13315 1/20 0.39
METAP1 P53582 1/20 0.39

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
SCHEMBL6657987 1.00 ALDH1A1 (0.53) ALDH1A1GAAMAPTL3MBTL1KDM4E
SCHEMBL14041334 0.83 MEN1 (0.57) ALDH1A1GAAMAPTL3MBTL1KDM4E
SCHEMBL6654011 0.83 ALDH1A1 (0.57) ALDH1A1GAAMAPTL3MBTL1KDM4E
SCHEMBL4746215 0.83 MEN1 (0.57) ALDH1A1GAAMAPTL3MBTL1KDM4E
SCHEMBL6654033 0.83 ALDH1A1 (0.57) ALDH1A1GAAMAPTL3MBTL1KDM4E
SCHEMBL8086322 0.81 ALDH1A1 (0.40) ALDH1A1GAAMAPTKDM4EMEN1
SCHEMBL6657626 0.80 ALDH1A1 (0.45) ALDH1A1GAAMAPTL3MBTL1KDM4E
SCHEMBL6657620 0.80 ALDH1A1 (0.45) ALDH1A1GAAMAPTL3MBTL1KDM4E
SCHEMBL6657919 0.76 MAPT (0.57) ALDH1A1GAAMAPTL3MBTL1KDM4E
SCHEMBL6657924 0.76 MAPT (0.57) ALDH1A1GAAMAPTL3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1041953-B1 AGENTS AND METHOD FOR PRODUCING TEMPORARY COLORATIONS OF KERATIN FIBERS WELLA AG (DE) 2004-07-07 EP claimed
US-6494923-B2 POLYMETHINE DYES, ESPECIALLY PYRAZOLONE DYES WELLA AKTIENGESELLSCHAFT (DE) 2002-12-17 US claimed
US-20020010969-A1 AGENTS AND METHOD FOR PRODUCING TEMPORARY COLORATIONS OF KERATIN FIBERS HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2002-01-31 US claimed
EP-1041953-A1 AGENTS AND METHOD FOR PRODUCING TEMPORARY COLORATIONS OF KERATIN FIBERS Wella Aktiengesellschaft (DE) 2000-10-11 EP claimed
WO-1999059528-A2 AGENTS AND METHOD FOR PRODUCING TEMPORARY COLORATIONS OF KERATIN FIBERS WELLA AKTIENGESELLSCHAFT (DE) 1999-11-25 WO claimed
EP-1041953-B1 AGENTS AND METHOD FOR PRODUCING TEMPORARY COLORATIONS OF KERATIN FIBERS WELLA AG (DE) 2004-07-07 EP disclosed
US-6494923-B2 POLYMETHINE DYES, ESPECIALLY PYRAZOLONE DYES WELLA AKTIENGESELLSCHAFT (DE) 2002-12-17 US disclosed
US-20020010969-A1 AGENTS AND METHOD FOR PRODUCING TEMPORARY COLORATIONS OF KERATIN FIBERS HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2002-01-31 US disclosed
EP-1041953-A1 AGENTS AND METHOD FOR PRODUCING TEMPORARY COLORATIONS OF KERATIN FIBERS Wella Aktiengesellschaft (DE) 2000-10-11 EP disclosed
WO-1999059528-A2 AGENTS AND METHOD FOR PRODUCING TEMPORARY COLORATIONS OF KERATIN FIBERS WELLA AKTIENGESELLSCHAFT (DE) 1999-11-25 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-20020010969-A1 AGENTS AND METHOD FOR PRODUCING TEMPORARY COLORATIONS OF KERATIN FIBERS KRT18, DSG1, SPTAN1 ALDH1A1 661/4885GAA 4503/4885MAPT 1524/4885

“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.