SCHEMBL14890983

SCHEMBL14890983

CN(C)Cc1c(CN(C)C)c(CN(C)C)c(CN(C)C)c(CN(C)C)c1CN(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
TSHR P16473 3/20 0.42
HRH3 Q9Y5N1 1/20 0.42
MAPT P10636 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 2/20 0.40
POLB P06746 1/20 0.40
THRB P10828 1/20 0.40
G6PD P11413 1/20 0.40
PABPC1 P11940 1/20 0.40
HKDC1 Q2TB90 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP3A4 P08684 1/20 0.39
TAAR1 Q96RJ0 1/20 0.35
CHRM2 P08172 1/20 0.34
CHRNA7 P36544 1/20 0.34
TNNI3 P19429 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
SCHEMBL6044950 0.84 MAPT (0.38) ALDH1A1TSHRHRH3MAPTTDP1
SCHEMBL10058699 0.79 MAPT (0.50) ALDH1A1TSHRHRH3MAPTTDP1
SCHEMBL1975892 0.74 MEN1 (0.64) ALDH1A1TSHRHRH3MAPTTDP1
SCHEMBL3199967 0.72 HTR1D (0.38) ALDH1A1TSHRHRH3MAPTTDP1
SCHEMBL15996298 0.72 CYP3A4 (0.45) ALDH1A1MAPTKDM4ECYP3A4UPP1
SCHEMBL6102517 0.72 SLC6A4 (0.45) ALDH1A1TSHRMAPTTDP1KDM4E
SCHEMBL2884631 0.72 CYP3A4 (0.32) MAPTCYP3A4UPP1
SCHEMBL659509 0.68 HRH3 (0.82) ALDH1A1TSHRHRH3POLBTAAR1
SCHEMBL2528801 0.68 ALDH1A1 (0.55) ALDH1A1TSHRHRH3MAPTTDP1
SCHEMBL320763 0.65

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-3653584-B1 DRAW SOLUTION WITH SWITCHABLE SALT ADDITIVE AND METHOD FOR DESALINATING AN AQUEOUS SOLUTION WITH THIS DRAW SOLUTION UNIV KINGSTON (CA) 2025-08-06 EP disclosed
US-11498853-B2 Water with switchable ionic strength QUEEN'S UNIVERSITY AT KINGSTON 2022-11-15 US disclosed
EP-3653584-A1 WATER WITH SWITCHABLE IONIC STRENGTH Queen's University At Kingston (CA) 2020-05-20 EP disclosed
EP-2651992-B1 METHOD FOR USE OF WATER WITH SWITCHABLE IONIC STRENGTH UNIV KINGSTON (CA) 2020-01-22 EP disclosed
EP-2534106-B1 METHOD FOR MODULATING IONIC STRENGTH UNIV KINGSTON (CA) 2019-10-16 EP disclosed
US-10377647-B2 Systems and methods for use of water with switchable ionic strength Queen's University at Kingson (CA) 2019-08-13 US disclosed
US-20140076810-A1 Systems and Methods for Use of Water with Switchable Ionic Strength Greencentre Canaga (US) 2014-03-20 US disclosed
US-20130105377-A1 Water with Switchable Ionic Strength QUEEN'S UNIVERSITY AT KINGSTON (CA) 2013-05-02 US disclosed