SCHEMBL2940169

SCHEMBL2940169

Cc1cc(O)cc(N2CCC(CCO)C2)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.36
MAPK1 P28482 5/20 0.36
TDP1 Q9NUW8 5/20 0.36
FFAR4 Q5NUL3 3/20 0.36
GAA P10253 3/20 0.35
KDM4E B2RXH2 2/20 0.35
ATM Q13315 1/20 0.35
NOTUM Q6P988 1/20 0.35
IRAK4 Q9NWZ3 1/20 0.35
AKR1C3 P42330 2/20 0.34
SYK P43405 4/20 0.34
ALDH1A1 P00352 2/20 0.33
BPTF Q12830 1/20 0.33
ESR2 Q92731 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL2932821 0.88 MAP2K7 (0.38) MAPTMAPK1TDP1FFAR4GAA
SCHEMBL2940628 0.83 FFAR4 (0.38) MAPTFFAR4IRAK4AKR1C3SYK
SCHEMBL2936433 0.83 MAPT (0.41) MAPTMAPK1TDP1FFAR4GAA
SCHEMBL2941565 0.82 IRAK4 (0.34) MAPTNOTUMIRAK4AKR1C3SYK
SCHEMBL2939187 0.80 DPP4 (0.47) FFAR4NOTUMESR2
SCHEMBL2942151 0.77 AR (0.41) FFAR4NOTUMALDH1A1
SCHEMBL2939391 0.76 MAPT (0.41) MAPTMAPK1TDP1GAAKDM4E
SCHEMBL2942470 0.72 NOTUM (0.66) NOTUM
SCHEMBL7801882 0.72 NOTUM (0.51) MAPTTDP1KDM4ENOTUMAKR1C3
SCHEMBL2940816 0.71 BPTF (0.33) NOTUMIRAK4BPTF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7491244-B2 Oxidizing hair coloring agents containing m-aminophenol derivatives THE PROCTER & GAMBLE COMPANY (US) 2009-02-17 US claimed
WO-2007020565-A1 OXIDIZING HAIR COLORING AGENTS CONTAINING M-AMINOPHENOL DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 2007-02-22 WO claimed
US-20070033745-A1 Developer substance-coupler substance of 3-(1-pyrrolidinyl)phenol and 1,4-diaminobenzene PROCTER & GAMBLE COMPANY, THE 2007-02-15 US claimed
EP-1752192-A1 Oxidizing hair coloring agents containing m-Aminophenol derivatives Wella Aktiengesellschaft (DE) 2007-02-14 EP claimed
EP-1752192-B1 Oxidizing hair coloring agents containing m-Aminophenol derivatives PROCTER & GAMBLE (US) 2010-02-03 EP disclosed
US-7491244-B2 Oxidizing hair coloring agents containing m-aminophenol derivatives THE PROCTER & GAMBLE COMPANY (US) 2009-02-17 US disclosed
WO-2007020565-A1 OXIDIZING HAIR COLORING AGENTS CONTAINING M-AMINOPHENOL DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 2007-02-22 WO disclosed
US-20070033745-A1 Developer substance-coupler substance of 3-(1-pyrrolidinyl)phenol and 1,4-diaminobenzene PROCTER & GAMBLE COMPANY, THE 2007-02-15 US disclosed
EP-1752192-A1 Oxidizing hair coloring agents containing m-Aminophenol derivatives Wella Aktiengesellschaft (DE) 2007-02-14 EP 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-20070033745-A1 Developer substance-coupler substance of 3-(1-pyrrolidinyl)phenol and 1,4-diaminobenzene TACR1, KRT18, AKR1C4 MAPT 2140/4885MAPK1 571/4885TDP1 2528/4885

“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.