SCHEMBL4801774

SCHEMBL4801774

Cc1cc(O)n(C(C)O)c(=O)c1C#N

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.55
MAPT P10636 3/20 0.49
ALDH1A1 P00352 3/20 0.49
MAPK1 P28482 1/20 0.49
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
THRB P10828 2/20 0.47
LMNA P02545 4/20 0.46
USP2 O75604 1/20 0.44
UPP1 Q16831 1/20 0.44
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL11042949 0.88 KDM4E (0.53) KDM4EMAPTALDH1A1MAPK1MEN1
SCHEMBL8043774 0.85 KDM4E (0.50) KDM4EMAPTALDH1A1MAPK1MEN1
SCHEMBL5365754 0.84 KDM4E (0.49) KDM4EMAPTALDH1A1MAPK1MEN1
SCHEMBL11228910 0.83 KDM4E (0.48) KDM4EMAPTALDH1A1MAPK1MEN1
SCHEMBL10962110 0.83 KDM4E (0.51) KDM4EMAPTALDH1A1MAPK1MEN1
SCHEMBL14342067 0.79 KDM4E (0.48) KDM4EMAPTALDH1A1MAPK1MEN1
SCHEMBL11238064 0.78 KDM4E (0.49) KDM4EMAPTALDH1A1MAPK1MEN1
SCHEMBL9013712 0.78 KDM4E (0.47) KDM4EMAPTALDH1A1MAPK1MEN1
SCHEMBL17009473 0.78 KDM4E (0.78) KDM4EMAPTALDH1A1MAPK1MEN1
SCHEMBL10618298 0.77 KDM4E (0.46) KDM4EMAPTALDH1A1MAPK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7429274-B2 Agent and method for the oxidative coloring of keratin fibers WELLA AG (DE) 2008-09-30 US claimed
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
US-7204857-B1 Dyeing method using a specific active methylene compound 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) 2007-04-17 US claimed
US-20070079452-A1 Agent and method for the oxidative coloring of keratin fibers Wella GmbH (DE) 2007-04-12 US claimed
US-9115464-B2 Particles for electrophoretic displays MERCK PATENT GMBH (DE) 2015-08-25 US disclosed
US-20120041165-A1 PARTICLES FOR ELECTROPHORETIC DISPLAYS MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2012-02-16 US disclosed
US-20110306742-A1 PARTICLES FOR ELECTROPHORETIC DISPLAYS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-12-15 US disclosed
WO-2010089057-A2 PARTICLES FOR ELECTROPHORETIC DISPLAYS MERCK PATENT GMBH (DE) 2010-08-12 WO disclosed
WO-2010089060-A2 PARTICLES FOR ELECTROPHORETIC DISPLAYS MERCK PATENT GMBH (DE) 2010-08-12 WO disclosed
WO-2010089059-A1 COLOURED PARTICLES FOR ELECTROPHORETIC DISPLAYS MERCK PATENT GMBH (DE) 2010-08-12 WO disclosed
US-7429274-B2 Agent and method for the oxidative coloring of keratin fibers WELLA AG (DE) 2008-09-30 US disclosed
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 disclosed
US-7204857-B1 Dyeing method using a specific active methylene compound 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) 2007-04-17 US disclosed
US-20070079452-A1 Agent and method for the oxidative coloring of keratin fibers Wella GmbH (DE) 2007-04-12 US disclosed
US-4015934-A EXHAUST DYEING; DISPERSE, MONOAZO DYES CIBA-GEIGY CORPORATION (US) 1977-04-05 US disclosed
US-3932122-A COLORING POLYESTER TEXTILES CIBA-GEIGY AG (CH) 1976-01-13 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 KDM4E 440/4885MAPT 685/4885ALDH1A1 83/4885
US-20110306742-A1 PARTICLES FOR ELECTROPHORETIC DISPLAYS RAB5IF, IK, SELP KDM4E 3448/4885MAPT 2386/4885ALDH1A1 1933/4885
US-20070079452-A1 Agent and method for the oxidative coloring of keratin fibers KRT18, KIT, CKMT1A; CKMT1B KDM4E 1324/4885MAPT 2255/4885ALDH1A1 129/4885

“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.