SCHEMBL94057

SCHEMBL94057

Nc1ccc2c(c1)NCC2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
KDM4E B2RXH2 3/20 0.53
MEN1 O00255 2/20 0.53
GAA P10253 2/20 0.53
KMT2A Q03164 2/20 0.53
CA9 Q16790 1/20 0.53
DRD2 P14416 1/20 0.44
DRD4 P21917 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
GFER P55789 1/20 0.42
APAF1 O14727 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 2/20 0.36
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35

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
Hydrochloric Acid SCHEMBL3872761 0.98 MAPT (0.52) MAPTKDM4EMEN1GAAKMT2A
Hydrochloric Acid SCHEMBL3996527 0.98 MAPT (0.52) MAPTKDM4EMEN1GAAKMT2A
Ethane SCHEMBL11793205 0.96 MAPT (0.50) MAPTKDM4EMEN1GAAKMT2A
SCHEMBL2555941 0.92 DRD2 (0.52) MAPTKDM4EMEN1GAAKMT2A
SCHEMBL29522368 0.88 MAPT (0.50) MAPTKDM4EMEN1GAAKMT2A
SCHEMBL1098919 0.88 MAPT (0.50) MAPTKDM4EMEN1GAAKMT2A
Hydrochloric Acid SCHEMBL29566172 0.86 MAPT (0.49) MAPTKDM4EMEN1GAAKMT2A
SCHEMBL2944234 0.86 KDM4E (0.49) MAPTKDM4EMEN1GAAKMT2A
Hydrochloric Acid SCHEMBL19743521 0.86 MAPT (0.49) MAPTKDM4EMEN1GAAKMT2A
Hydrochloric Acid SCHEMBL16337538 0.86 MAPT (0.49) MAPTKDM4EMEN1GAAKMT2A

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 1264 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021018445-A1 OXIDANT-FREE METHOD FOR DYEING KERATIN MATERIAL, COMPRISING THE APPLICATION OF AN ORGANIC C1-C6-ALKOXY SILANE AND AN OXIDANT-FREE DYE PRECURSOR HENKEL AG & CO. KGAA (DE) 2021-02-04 WO claimed
CN-110669058-A Tricyclic quinolone carboxylic acid and preparation method thereof 江西农业大学 2020-01-10 CN claimed
US-8629289-B2 Method for the preparation of 1-acetyl-6-amino-3,3-dimethyl-2,3-dihydroindole AMGEN INC. (US) 2014-01-14 US claimed
US-8585778-B2 Cationic 6-aminoindolines, dyeing compositions containing them, processes and uses thereof L'OREAL (FR) 2013-11-19 US claimed
US-20130081213-A1 CATIONIC 6-AMINOINDOLINES, DYEING COMPOSITIONS CONTAINING THEM, PROCESSES AND USES THEREOF L'OREAL (FR) 2013-04-04 US claimed
EP-2542525-A1 CATIONIC 6-AMINOINDOLINES, DYEING COMPOSITIONS CONTAINING THEM, PROCESSES AND USES THEREOF L'Oréal (FR) 2013-01-09 EP claimed
US-20120136163-A1 Method for the Preparation of 1-Acetyl-6-Amino-3,3-Dimethyl-2,3-Dihydroindole AMGEN INC. (US) 2012-05-31 US claimed
EP-2376448-A2 IMPROVED METHOD FOR THE PREPARATION OF 1-ACETYL-6-AMINO-3,3-DIMETHYL-2,3-DIHYDROINDOLE Amgen, Inc (US) 2011-10-19 EP claimed
WO-2011107501-A1 CATIONIC 6-AMINOINDOLINES, DYEING COMPOSITIONS CONTAINING THEM, PROCESSES AND USES THEREOF L'OREAL (FR) 2011-09-09 WO claimed
EP-2311801-A1 6-amino(aza)indane compounds suitable for treating disorders that respond to modulation of the dopamine d3 receptor Abbott GmbH & Co. KG (DE) 2011-04-20 EP claimed
EP-0575604-A1 INDOLINE PRODUCTS, METHODS FOR PREPARING SAME, AND USE THEREOF IN COSMETICS. OREAL (FR) 1993-12-29 EP claimed
EP-0575605-A1 MINERAL OR ORGANIC PARTICLE BASED PRODUCT COMPRISING AN INDOLINE PRODUCT. OREAL (FR) 1993-12-29 EP claimed
US-5256799-A Preparation of 6-hydroxyindolines and their use for preparation of novel laser dyes THE UNITED STATES OF AMERICAS AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1993-10-26 US claimed
WO-1993013745-A1 MINERAL OR ORGANIC PARTICLE BASED PRODUCT COMPRISING AN INDOLINE PRODUCT L'OREAL (FR) 1993-07-22 WO claimed
WO-1993013744-A1 INDOLINE PRODUCTS, METHODS FOR PREPARING SAME, AND USE THEREOF IN COSMETICS L'OREAL (FR) 1993-07-22 WO claimed
EP-0544874-A1 METHOD FOR PREPARING SUBMICRON PARTICLES IN THE PRESENCE OF LIPID VESICLES, AND CORRESPONDING COMPOSITIONS L'OREAL (FR) 1993-06-09 EP claimed
US-5190564-A PROCESS FOR DYEING KERATINOUS FIBRES COMBINING ISATIN OR ITS DERIVATIVES WITH AN AMINOINDOLE OR AN AMINOINDOLINE, AND COMPOSITIONS USED L'OREAL (FR) 1993-03-02 US claimed
WO-1993000068-A1 METHOD FOR PREPARING SUBMICRON PARTICLES IN THE PRESENCE OF LIPID VESICLES, AND CORRESPONDING COMPOSITIONS L'OREAL (FR) 1993-01-07 WO claimed
EP-0497697-A1 Keratinous fibres dyeing process with isatine associated with an aminoindol or an aminoindoline, and composition therefor L'OREAL (FR) 1992-08-05 EP claimed
US-4425132-A HAIR DYES, APPLYING WITHOUT RINSING L'OREAL (FR) 1984-01-10 US claimed

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-20120136163-A1 Method for the Preparation of 1-Acetyl-6-Amino-3,3-Dimethyl-2,3-Dihydroindole AANAT, INMT, AADAT MAPT 928/4885KDM4E 1483/4885MEN1 1108/4885
US-20130081213-A1 CATIONIC 6-AMINOINDOLINES, DYEING COMPOSITIONS CONTAINING THEM, PROCESSES AND USES THEREOF AADAT, TYR, DDC MAPT 1560/4885KDM4E 1899/4885MEN1 1026/4885

“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.