SCHEMBL2593556

SCHEMBL2593556

Nc1ccc(Oc2ccccc2C(F)(F)C(F)(c2ccc(O)c(N)c2)C(F)(F)F)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.37
RAB9A P51151 3/20 0.37
AR P10275 1/20 0.36
MAPT P10636 5/20 0.35
ALDH1A1 P00352 3/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
GAA P10253 2/20 0.35
RECQL P46063 2/20 0.35
PKM P14618 1/20 0.35
NCOA1 Q15788 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
LMNA P02545 1/20 0.35
ATM Q13315 1/20 0.35
THRB P10828 3/20 0.34
THRA P10827 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
NPC1 O15118 2/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL5583604 0.81 NCOA1 (0.45) L3MBTL1RAB9AARMAPTALDH1A1
SCHEMBL10436537 0.77 MAOA (0.43) L3MBTL1RAB9AMAPTALDH1A1MEN1
SCHEMBL3822428 0.73 ALDH1A1 (0.53) ARMAPTALDH1A1MEN1KMT2A
SCHEMBL10390912 0.72 MAOA (0.46) L3MBTL1RAB9AMAPTALDH1A1MEN1
SCHEMBL1025130 0.72 ALDH1A1 (0.59) ARMAPTALDH1A1MEN1KMT2A
4-Phenoxyaniline SCHEMBL2593558 0.71 MAOA (0.44) L3MBTL1RAB9AMAPTALDH1A1MEN1
SCHEMBL721404 0.71 NCOA1 (0.49) L3MBTL1RAB9AARMAPTALDH1A1
SCHEMBL28659616 0.71 MAOA (0.44) RAB9AMAPTALDH1A1MEN1KMT2A
SCHEMBL29553142 0.70 NCOA1 (0.51) L3MBTL1RAB9AARMAPTALDH1A1
SCHEMBL476252 0.70 NCOA1 (0.51) L3MBTL1RAB9AARMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2569081-A1 POLYMERS, POLYMER MEMBRANES AND METHODS OF PRODUCING THE SAME Air Products and Chemicals, Inc. (US) 2013-03-20 EP disclosed
US-20130047844-A1 POLYMERS, POLYMER MEMBRANES AND METHODS OF PRODUCING THE SAME AIR PRODUCTS AND CHEMICALS, INC. (US) 2013-02-28 US disclosed
WO-2011143530-A1 POLYMERS, POLYMER MEMBRANES AND METHODS OF PRODUCING THE SAME AIR PRODUCTS AND CHEMICALS, INC. (US) 2011-11-17 WO disclosed