SCHEMBL5190941

SCHEMBL5190941

CN(C)CCCc1cc(N)ccc1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.54
ACHE P22303 3/20 0.53
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
HTR1A P08908 1/20 0.44
CYP2D6 P10635 1/20 0.44
ALOX15 P16050 1/20 0.44
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
CYP2C19 P33261 1/20 0.44
SLC6A4 P31645 3/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
PDE10A Q9Y233 1/20 0.41
HTR7 P34969 1/20 0.39
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL5192245 0.89 PRKCI (0.58) PRKCIACHEALDH1A1MAPTTDP1
SCHEMBL5192142 0.83 PRKCI (0.70) PRKCIACHEALDH1A1MAPTTDP1
SCHEMBL14875929 0.82 NOS1 (0.40) PRKCIACHESLC6A4NOS3NOS1
SCHEMBL427400 0.81 TAAR1 (0.43) ALDH1A1CYP3A4SLC6A4KMT2ANOS3
SCHEMBL309824 0.80 PRKCI (0.59) PRKCIACHEMAPTTDP1CYP3A4
SCHEMBL3338265 0.80 PRKCI (0.69) PRKCIACHEALDH1A1MAPTTDP1
SCHEMBL29834174 0.80 PRKCI (0.69) PRKCIACHEALDH1A1MAPTTDP1
SCHEMBL21214846 0.79 PRKCI (0.59) PRKCIACHEALDH1A1MAPTTDP1
SCHEMBL8590051 0.79 SLC6A4 (0.43) PRKCISLC6A4NOS3NOS1NOS2
SCHEMBL3579492 0.79 PRKCI (0.58) PRKCIACHEALDH1A1MAPTTDP1

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 4672/4885ALDH1A1 70/4885
US-20040211011-A1 Primary intermediates for oxidative coloration of hair CYC1, MT-CO1, MT-ND1 PRKCI 3484/4885ACHE 4672/4885ALDH1A1 70/4885

“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.