SCHEMBL693273

SCHEMBL693273

Cc1cc(=O)n(-c2ncc(C(=O)O)[nH]2)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.56
KDM4E B2RXH2 5/20 0.56
TDP1 Q9NUW8 2/20 0.56
POLB P06746 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
KDM5A P29375 1/20 0.50
KDM2B Q8NHM5 1/20 0.50
KDM4C Q9H3R0 1/20 0.50
ALDH1A1 P00352 6/20 0.49
KMT2A Q03164 5/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
ALPL P05186 1/20 0.49
ALKBH3 Q96Q83 1/20 0.45
MEN1 O00255 2/20 0.42
GAA P10253 2/20 0.42
HTT P42858 2/20 0.42
ALKBH5 Q6P6C2 9/20 0.40
LMNA P02545 1/20 0.37
RECQL P46063 1/20 0.37
PIN1 Q13526 1/20 0.36

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
SCHEMBL693219 0.72 KMT2A (0.55) MAPTKDM4ETDP1POLBL3MBTL1
SCHEMBL27945452 0.68 BAZ2B (0.53) KDM4EALDH1A1SMN1; SMN2LMNAPIN1
SCHEMBL11435207 0.67 ALDH1A1 (0.60) MAPTKDM4ETDP1POLBL3MBTL1
SCHEMBL889035 0.66
SCHEMBL394287 0.66 ALDH1A1 (1.00) MAPTKDM4ETDP1POLBL3MBTL1
Water SCHEMBL5369986 0.64 BAZ2B (0.53) KDM4EALDH1A1SMN1; SMN2LMNAPIN1
SCHEMBL27853139 0.64 BAZ2B (0.53) MAPTKDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL11589085 0.64 ALDH1A1 (0.68) MAPTKDM4ETDP1KDM5AKDM2B
Methyl Alcohol SCHEMBL1028813 0.63 MAPT (0.69) MAPTKDM4ETDP1POLBL3MBTL1
SCHEMBL699450 0.63 ALDH1A1 (0.54) MAPTKDM4ETDP1POLBKDM5A

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
EP-2421613-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND A CHELANT AND USE THEREOF The Procter & Gamble Company (US) 2012-02-29 EP claimed
US-7985266-B2 Keratin dyeing compositions comprising a radical scavenger and a chelant and use thereof THE PROCTER & GAMBLE COMPANY (US) 2011-07-26 US claimed
US-20110035886-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and a Chelant and Use Thereof NOXELL CORPORATION 2011-02-17 US claimed
WO-2010123866-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND A CHELANT AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2010-10-28 WO claimed
EP-2421613-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND A CHELANT AND USE THEREOF The Procter & Gamble Company (US) 2012-02-29 EP disclosed
US-7985266-B2 Keratin dyeing compositions comprising a radical scavenger and a chelant and use thereof THE PROCTER & GAMBLE COMPANY (US) 2011-07-26 US disclosed
US-20110035886-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and a Chelant and Use Thereof NOXELL CORPORATION 2011-02-17 US disclosed
WO-2010123866-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND A CHELANT AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2010-10-28 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-20110035886-A1 Keratin Dyeing Compositions Comprising a Radical Scavenger and a Chelant and Use Thereof KRT18, LPO, KRTCAP2 MAPT 547/4885KDM4E 509/4885TDP1 3026/4885

“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.