SCHEMBL5192142

SCHEMBL5192142

CCN(CC)CCCc1cc(N)ccc1O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.70
ACHE P22303 4/20 0.68
POLB P06746 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46
APEX1 P27695 1/20 0.46
HTT P42858 1/20 0.46
RECQL P46063 1/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
KMT2A Q03164 1/20 0.46
MCL1 Q07820 1/20 0.46
HKDC1 Q2TB90 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
JAK2 O60674 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
SCHEMBL5190111 0.90 PRKCI (0.74) PRKCIACHEPOLBALDH1A1MAPK1
SCHEMBL5190941 0.83 PRKCI (0.54) PRKCIACHEPOLBALDH1A1KDM4E
SCHEMBL20869672 0.83 PRKCI (0.50) PRKCIACHEALDH1A1MAPK1MAPT
SCHEMBL29565648 0.83 PRKCI (1.00) PRKCIACHEPOLBALDH1A1MAPK1
SCHEMBL111109 0.83 PRKCI (1.00) PRKCIACHEPOLBALDH1A1MAPK1
SCHEMBL309824 0.81 PRKCI (0.59) PRKCIACHEMAPK1MEN1MAPT
Hydrochloric Acid SCHEMBL1998656 0.81 ACHE (1.00) PRKCIACHEPOLBALDH1A1MAPK1
Hydrochloric Acid SCHEMBL1998660 0.81 ACHE (1.00) PRKCIACHEPOLBALDH1A1MAPK1
SCHEMBL6175929 0.81 PRKCI (0.47) PRKCIACHEKDM4EMAPTMPO
SCHEMBL3579492 0.80 PRKCI (0.58) PRKCIACHEALDH1A1KDM4EMEN1

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-1361851-B1 PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR P & G CLAIROL INC (US) 2007-02-21 EP disclosed
US-7070630-B2 Primary intermediates for oxidative coloration of hair THE PROCTER & GAMBLE COMPANY (US) 2006-07-04 US disclosed
EP-1361851-A4 PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR P & G CLAIROL INC (US) 2004-12-15 EP disclosed
US-20040211011-A1 Primary intermediates for oxidative coloration of hair THE PROCTER & GAMBLE COMPANY 2004-10-28 US disclosed
US-6750339-B2 SUCH AS 4-AMINO-2-(2-DIMETHYLAMINO-ETHYL)-PHENOL; USEFUL IN PLACE OF P-AMINOPHENOL THE PROCTER AND GAMBLE COMPANY 2004-06-15 US disclosed
EP-1361851-A1 PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR P & G-Clairol, Inc. (US) 2003-11-19 EP disclosed
US-20020148052-A1 Primary intermediates for oxidative coloration of hair WELLA OPERATIONS US, LLC 2002-10-17 US disclosed
WO-2002058653-A1 PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR P&G CLAIROL, INC. (US) 2002-08-01 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 (2 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-20020148052-A1 Primary intermediates for oxidative coloration of hair CYC1, MT-CO1, MT-ND1 PRKCI 3484/4885ACHE 4672/4885POLB 351/4885
US-20040211011-A1 Primary intermediates for oxidative coloration of hair CYC1, MT-CO1, MT-ND1 PRKCI 3484/4885ACHE 4672/4885POLB 351/4885

“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.