SCHEMBL14435900

SCHEMBL14435900

CN1/C(=C\C=C\C=C2C(=O)c3ccccc3C2=O)Sc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.48
MAPT P10636 8/20 0.48
HPGD P15428 1/20 0.48
MAOA P21397 1/20 0.46
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
HSD17B10 Q99714 2/20 0.45
NPC1 O15118 10/20 0.44
RAB9A P51151 10/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
NFKB1 P19838 3/20 0.44
NFKB2 Q00653 3/20 0.44
RELA Q04206 3/20 0.44
TP53 P04637 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
PKM P14618 2/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
CASP1 P29466 1/20 0.44

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
SCHEMBL15726368 0.84 ALDH1A1 (0.44) ALDH1A1MAPTHPGDMAOAMEN1
SCHEMBL25849797 0.81 ALDH1A1 (0.46) ALDH1A1MAPTHPGDMAOAMEN1
SCHEMBL25850039 0.80 ELANE (0.45) ALDH1A1MAPTHPGDMAOAMEN1
SCHEMBL25851505 0.79 ALDH1A1 (0.42) ALDH1A1MAPTHPGDMAOAMEN1
SCHEMBL25849804 0.78 MAPT (0.41) ALDH1A1MAPTHPGDMAOAMEN1
SCHEMBL10621158 0.77 ALDH1A1 (0.57) ALDH1A1MAPTHPGDMAOAMEN1
SCHEMBL10621154 0.77 ALDH1A1 (0.57) ALDH1A1MAPTHPGDMAOAMEN1
SCHEMBL13445655 0.77 ALDH1A1 (0.50) ALDH1A1MAPTHPGDMAOAMEN1
SCHEMBL9290213 0.76 KMT2A (0.47) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL6909874 0.74 NPC1 (0.46) ALDH1A1MAPTHPGDMAOAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7262252-B2 Nonlinear optical materials comprising fluorine-containing polymer DAIKIN INDUSTRIES, LTD. (JP) 2007-08-28 US disclosed
US-7262252-B2 Nonlinear optical materials comprising fluorine-containing polymer DAIKIN INDUSTRIES, LTD. (JP) 2007-08-28 US disclosed