SCHEMBL8942519

SCHEMBL8942519

ON=Cc1ccc2ccccc2c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.54
KMT2A Q03164 5/20 0.54
ALDH1A1 P00352 4/20 0.54
CASP1 P29466 1/20 0.54
CASP7 P55210 1/20 0.54
KDM4E B2RXH2 5/20 0.50
MEN1 O00255 3/20 0.50
HPGD P15428 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
PTPN22 Q9Y2R2 1/20 0.50
TDP2 O95551 1/20 0.50
THRB P10828 1/20 0.50
RECQL P46063 1/20 0.50
GAA P10253 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
L3MBTL1 Q9Y468 4/20 0.49
LMNA P02545 2/20 0.48
POLB P06746 1/20 0.46

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
SCHEMBL11770105 1.00 MAPT (0.54) MAPTKMT2AALDH1A1CASP1CASP7
SCHEMBL8942514 1.00 MAPT (0.54) MAPTKMT2AALDH1A1CASP1CASP7
SCHEMBL2316368 0.83 KMT2A (0.52) MAPTKMT2AALDH1A1CASP1CASP7
SCHEMBL14337489 0.80 KMT2A (0.64) MAPTKMT2AALDH1A1CASP1CASP7
SCHEMBL31251475 0.79 CYP2A6 (0.48) MAPTKMT2AALDH1A1KDM4EMEN1
SCHEMBL11367227 0.79 CYP2A6 (0.48) MAPTKMT2AALDH1A1KDM4EMEN1
SCHEMBL533800 0.78 GRIN2D (0.59) MAPTKMT2AALDH1A1KDM4EMEN1
SCHEMBL413024 0.78 GRIN2D (0.59) MAPTKMT2AALDH1A1KDM4EMEN1
SCHEMBL31511413 0.78 GRIN2D (0.59) MAPTKMT2AALDH1A1KDM4EMEN1
SCHEMBL7898857 0.78 GRIN2D (0.59) MAPTKMT2AALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0584988-B1 Process for the preparation of salicylaldoxine derivatives ZENECA LTD (GB) 1996-10-23 EP disclosed
US-5502254-A Method for the preparation of 2-hydroxyarylaldoximes ZENECA LIMITED (GB) 1996-03-26 US disclosed
US-5399761-A Method for the preparation of 2-hydroxyarylaldoximes ZENECA LIMITED (GB) 1995-03-21 US disclosed
EP-0584988-A1 Process for the preparation of salicylaldoxine derivatives ZENECA LIMITED (GB) 1994-03-02 EP disclosed
US-3948861-A Polyamide-imides from bis-imide and dialdoxime RHONE-POULENC S.A. (FR) 1976-04-06 US disclosed