SCHEMBL5154804

SCHEMBL5154804

CC1=C(O)C(=O)C=C(O)C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XIAP P98170 8/20 0.54
ALOX5 P09917 11/20 0.44
MPEG1 Q2M385 7/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPT P10636 3/20 0.44
MAPK1 P28482 3/20 0.44
GPR84 Q9NQS5 2/20 0.44
HPGD P15428 2/20 0.44
MEN1 O00255 2/20 0.44
USP2 O75604 2/20 0.44
KMT2A Q03164 2/20 0.44
PTGES O14684 1/20 0.44
TP53 P04637 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
CYP2C19 P33261 1/20 0.44
KAT2B Q92831 1/20 0.44

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
SCHEMBL199946 0.82 XIAP (0.45) XIAPALOX5MPEG1KDM4EALDH1A1
SCHEMBL5712778 0.80 XIAP (0.48) XIAPALOX5MPEG1KDM4EALDH1A1
SCHEMBL9220665 0.76 XIAP (0.54) XIAPALOX5MPEG1KDM4EALDH1A1
SCHEMBL29098299 0.74 XIAP (0.52) XIAPALOX5MPEG1KDM4EALDH1A1
SCHEMBL15212939 0.73 ALOX5 (0.50) ALOX5MPEG1KDM4EMAPTMAPK1
SCHEMBL20098763 0.73 MALT1 (0.41) XIAPKDM4EALDH1A1MAPTMAPK1
SCHEMBL28803752 0.70 XIAP (0.48) XIAPALOX5MPEG1KDM4EALDH1A1
SCHEMBL29140682 0.70 XIAP (0.48) XIAPALOX5MPEG1KDM4EALDH1A1
SCHEMBL5158181 0.70 XIAP (0.48) XIAPALOX5MPEG1KDM4EALDH1A1
SCHEMBL9175113 0.70 XIAP (1.00) XIAPALOX5MPEG1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070130702-A1 Dyeing process using a specific compound containing active methylene and a compound chosen from a specific aldehyde, a specific ketone, a quinone and a diiminoisoindoline or 3-aminoisoindolone derivative L'OREAL S.A. 2007-06-14 US claimed
EP-1754514-A1 Agent and method for colouring keratin fibres Wella Aktiengesellschaft (DE) 2007-02-21 EP claimed
US-20070000073-A1 Agent and method for colouring keratin fibres PROCTER & GAMBLE COMPANY, THE 2007-01-04 US claimed
WO-2006094217-A2 AGENT AND METHOD FOR COLOURING KERATIN FIBRES THE PROCTER & GAMBLE COMPANY (US) 2006-09-08 WO claimed
US-7070625-B2 Agent and method for coloring keratin fibers containing 2-benzothiazolinone-hydrazone and quinone derivatives WELLA AG (DE) 2006-07-04 US claimed
EP-1448540-A1 AGENT AND METHOD FOR COLORING KERATIN FIBERS CONTAINING 2-BENZOTHIAZOLINONE-HYDRAZONE AND QUINONE DERIVATIVES Wella Aktiengesellschaft (DE) 2004-08-25 EP claimed
EP-1434552-A1 METHOD FOR DYEING KERATINOUS FIBRES Henkel Kommanditgesellschaft auf Aktien (DE) 2004-07-07 EP claimed
US-20040060124-A1 Agent and method for coloring keratin fibers containing 2-benzothiazolinone-hydrazone and quinone derivatives HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2004-04-01 US claimed
US-6635090-B1 Dyeing method using a specific cationic derivative and a compound selected among a specific aldehyde, a specific ketone, a quinone and a di-imino-isoindoline or 3-amino-isoindolone derivative L'OREAL, S.A. (FR) 2003-10-21 US claimed
WO-2003042199-A1 AGENT AND METHOD FOR COLORING KERATIN FIBERS CONTAINING 2-BENZOTHIAZOLINONE-HYDRAZONE AND QUINONE DERIVATIVES WELLA AKTIENGESELLSCHAFT (DE) 2003-05-22 WO claimed
WO-2003030841-A1 METHOD FOR DYEING KERATINOUS FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-04-17 WO claimed
US-6458168-B1 Hair dyeing method using an aliphatic cationic amine and compound chosen from an aldehyde, a ketone, a quinone, a di-imino-isoindoline, and a 3-aminoisoindolone derivative L'OREAL S.A. (FR) 2002-10-01 US claimed
US-6451067-B1 HAIR DYE MIXTURE L'OREAL S.A. (FR) 2002-09-17 US claimed
EP-0498707-B1 Process of dyeing keratinous fibers with a mono- or di-hydroxyindole and a non-oxidative aromatic carbonyl derivative and dyeing agent OREAL (FR) 1995-08-02 EP claimed
EP-0498707-A1 Process of dyeing keratinous fibers with a mono- or di-hydroxyindole and a non-oxidative aromatic carbonyl derivative and dyeing agent L'OREAL (FR) 1992-08-12 EP claimed
US-5064442-A HAIR DYES L'OREAL (FR) 1991-11-12 US claimed
US-4971596-A COPPER, COBALT, IRON OR SILVER SALTS WITH QUINONE DYES L'OREAL (FR) 1990-11-20 US claimed
US-4832943-A HYDROXYQUINONE, MESOTARTARALDEHYDE L'OREAL (FR) 1989-05-23 US claimed
EP-3843696-B1 PROCESS AND COMPOSITION FOR COLORING KERATIN FIBERS OREAL (FR) 2025-04-09 EP disclosed
US-4750908-A 2,3-INDOLINEDIONE L'OREAL (FR) 1988-06-14 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 (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-20070130702-A1 Dyeing process using a specific compound containing active methylene and a compound chosen from a specific aldehyde, a specific ketone, a quinone and a diiminoisoindoline or 3-aminoisoindolone derivative KRT18, NDUFB5, NDUFB7 XIAP 1520/4885ALOX5 798/4885MPEG1 3564/4885
US-20040060124-A1 Agent and method for coloring keratin fibers containing 2-benzothiazolinone-hydrazone and quinone derivatives KRT18, NDUFA1, NDUFA2 XIAP 3285/4885ALOX5 4244/4885MPEG1 4122/4885
US-20070000073-A1 Agent and method for colouring keratin fibres KRT18, CDC73, OAT XIAP 2602/4885ALOX5 4492/4885MPEG1 4374/4885

“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.