SCHEMBL1826388

SCHEMBL1826388

CNC(C)C(=O)c1ccc2c(c1)OOC2

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 2/20 0.48
KDM4E B2RXH2 1/20 0.35
DBH P09172 1/20 0.35
GAA P10253 1/20 0.35
RECQL P46063 1/20 0.35
SLC6A2 P23975 5/20 0.35
CHRNA1 P02708 4/20 0.35
CHRNG P07510 4/20 0.35
CHRNB1 P11230 4/20 0.35
CHRNB2 P17787 4/20 0.35
CHRNB4 P30926 4/20 0.35
CHRNA3 P32297 4/20 0.35
CHRNA4 P43681 4/20 0.35
SLC6A3 Q01959 4/20 0.35
CHRND Q07001 4/20 0.35
SLC6A4 P31645 3/20 0.33
ALDH1A1 P00352 2/20 0.32
RAB9A P51151 2/20 0.32
HPGD P15428 1/20 0.32
MEN1 O00255 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
SCHEMBL11235233 0.79 HDAC8 (0.42) GAARAB9AHPGDMEN1KMT2A
SCHEMBL5098817 0.77 NPC1 (0.50) KDM4ERECQLALDH1A1RAB9AHPGD
SCHEMBL9709462 0.75 MEN1 (0.42) KDM4EALDH1A1RAB9AHPGDMEN1
SCHEMBL11215650 0.75 ALDH1A1 (0.50) KDM4EGAAALDH1A1MEN1KMT2A
Methylone SCHEMBL25263013 0.75 ALDH1A1 (0.56) HTR1BGAAALDH1A1RAB9AMEN1
Methylone SCHEMBL1826389 0.75 ALDH1A1 (0.56) HTR1BGAAALDH1A1RAB9AMEN1
Methylone SCHEMBL22027324 0.75 ALDH1A1 (0.56) HTR1BGAAALDH1A1RAB9AMEN1
Methylone SCHEMBL29403494 0.75 ALDH1A1 (0.56) HTR1BGAAALDH1A1RAB9AMEN1
Methylone SCHEMBL25167171 0.74 ALDH1A1 (0.54) HTR1BGAAALDH1A1RAB9AMEN1
Methylone SCHEMBL25167975 0.74 ALDH1A1 (0.54) HTR1BGAAALDH1A1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2318126-B1 WATER PURIFICATION MEMBRANES WITH IMPROVED FOULING RESISTANCE UNIV TEXAS (US) 2018-08-22 EP disclosed
US-8017050-B2 Water purification membranes with improved fouling resistance BOARD OF REGENTS THE UNIVERSITY OF TEXAS SYSTEM (US) 2011-09-13 US disclosed
EP-2318126-A2 WATER PURIFICATION MEMBRANES WITH IMPROVED FOULING RESISTANCE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2011-05-11 EP disclosed
US-20100059433-A1 POLYMER DEPOSITION AND MODIFICATION OF MEMBRANES FOR FOULING RESISTANCE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-03-11 US disclosed
US-20100051538-A1 WATER PURIFICATION MEMBRANES WITH IMPROVED FOULING RESISTANCE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-03-04 US disclosed
WO-2010006196-A2 WATER PURIFICATION MEMBRANES WITH IMPROVED FOULING RESISTANCE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-01-14 WO disclosed
WO-2008100977-A2 CARBAMATES THERAPEUTIC RELEASE AGENTS AS AMIDASE INHIBITORS N.V. ORGANON (NL) 2008-08-21 WO disclosed