SCHEMBL20072741

SCHEMBL20072741

CC(C)[PH](=O)c1ccccc1-c1ccccc1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.38
ALDH1A1 P00352 1/20 0.38
BCL2L1 Q07817 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PTPN1 P18031 1/20 0.37
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
MAOA P21397 2/20 0.35
KMT2A Q03164 2/20 0.35
BCL2 P10415 1/20 0.35
MCL1 Q07820 1/20 0.35
BAZ2B Q9UIF8 1/20 0.35
BAZ2A Q9UIF9 1/20 0.35
ADORA2A P29274 1/20 0.35
APAF1 O14727 2/20 0.34
TDP2 O95551 2/20 0.34
IDO1 P14902 1/20 0.34
KDR P35968 1/20 0.34

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
SCHEMBL23280616 0.86 ADORA2A (0.36) HPGDALDH1A1BCL2L1HSD17B10PTPN1
SCHEMBL20460718 0.83 ALDH1A1 (0.37) HPGDALDH1A1BCL2L1HSD17B10PTPN1
Isopropylamine SCHEMBL2177330 0.79 ADORA2A (0.36) HPGDALDH1A1BCL2L1HSD17B10PTPN1
SCHEMBL12284074 0.79 HPGD (0.41) HPGDALDH1A1BCL2L1HSD17B10PTPN1
SCHEMBL22732401 0.78 ALDH1A1 (0.38) HPGDALDH1A1BCL2L1HSD17B10PTPN1
SCHEMBL822716 0.76 ALDH1A1 (0.43) HPGDALDH1A1BCL2L1HSD17B10PTPN1
SCHEMBL20613696 0.75 ALDH1A1 (0.41) HPGDALDH1A1BCL2L1HSD17B10PTPN1
SCHEMBL23114236 0.74 TSHR (0.41) HPGDALDH1A1BCL2L1HSD17B10PTPN1
Zinc Ion SCHEMBL1083125 0.73 ALDH1A1 (0.40) HPGDALDH1A1BCL2L1HSD17B10PTPN1
SCHEMBL6013462 0.73 ALDH1A1 (0.40) HPGDALDH1A1BCL2L1HSD17B10PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018069249-A1 FLAME RETARDANTS BRUAG FIRE PROTECTION AG (CH) 2018-04-19 WO disclosed