SCHEMBL15069341

SCHEMBL15069341

c1ccc(-c2ccc(-c3cccc(-c4ccccc4)c3-c3ccccc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
HSD17B10 Q99714 3/20 0.46
BCL2L1 Q07817 2/20 0.46
MAPK1 P28482 2/20 0.46
HPGD P15428 1/20 0.46
CYP2A6 P11509 1/20 0.46
HNF4A P41235 1/20 0.45
HDAC4 P56524 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
TAAR1 Q96RJ0 2/20 0.44
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
HTT P42858 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MMP3 P08254 1/20 0.43
BACE1 P56817 1/20 0.42

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
SCHEMBL192418 0.94 ALDH1A1 (0.50) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL24117506 0.92 ALDH1A1 (0.44) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL2806539 0.92 ALDH1A1 (0.48) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
Ammonia Solution, Strong SCHEMBL21647364 0.92 ALDH1A1 (0.48) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
Charcoal, Activated SCHEMBL30690883 0.92 ALDH1A1 (0.48) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL9469764 0.92 ALDH1A1 (0.48) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
Water SCHEMBL432858 0.92 ALDH1A1 (0.48) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
Phosphine SCHEMBL10935474 0.92 ALDH1A1 (0.48) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL28995730 0.92 ALDH1A1 (0.48) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL29093087 0.92 ALDH1A1 (0.48) ALDH1A1HSD17B10BCL2L1MAPK1HPGD

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
EP-2798013-A1 ANTI-REFLECTIVE COATING Leibniz-Institut für Neue Materialien gemeinnützige GmbH (DE) 2014-11-05 EP disclosed
WO-2013098090-A1 ANTI-REFLECTIVE COATING LEIBNIZ-INSTITUT FÜR NEUE MATERIALIEN GEMEINNÜTZIGE GMBH (DE) 2013-07-04 WO disclosed