SCHEMBL8611053

SCHEMBL8611053

Oc1ccc2ccccc2c1-c1ccccc1Pc1ccccc1-c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.46
HSP90AB1 P08238 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GPR84 Q9NQS5 1/20 0.40
NSD2 O96028 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
HKDC1 Q2TB90 1/20 0.40
ALOX5 P09917 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
PTPN22 Q9Y2R2 1/20 0.37
MCL1 Q07820 1/20 0.35
ACMSD Q8TDX5 1/20 0.35

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
SCHEMBL8614233 0.87 HSP90AA1 (0.39) HSP90AA1HSP90AB1L3MBTL1MAPTTHRB
SCHEMBL8612683 0.77 MAPT (0.46) HSP90AA1HSP90AB1MAPTGPR84NSD2
SCHEMBL8614235 0.74 HSP90AA1 (0.39) HSP90AA1HSP90AB1L3MBTL1MAPTTHRB
SCHEMBL482437 0.73 DNMT1 (0.40) L3MBTL1MAPTMAPK1TDP1GPR84
SCHEMBL9950485 0.73 NSD2 (0.50) HSP90AA1HSP90AB1L3MBTL1MAPTTHRB
SCHEMBL8611708 0.71 HSP90AA1 (0.49) HSP90AA1HSP90AB1L3MBTL1MAPTTHRB
Hydrochloric Acid SCHEMBL29492626 0.71 NSD2 (0.51) HSP90AA1HSP90AB1MAPTNSD2OPRM1
SCHEMBL29360295 0.70 NSD2 (0.54) HSP90AA1HSP90AB1MAPTTDP1NSD2
SCHEMBL6403846 0.70 NSD2 (0.54) HSP90AA1HSP90AB1MAPTNSD2OPRM1
SCHEMBL214870 0.70 NSD2 (0.54) HSP90AA1HSP90AB1MAPTTDP1NSD2

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-5789623-A Process for the preparation of hydroxybiarylphosphines and novel compounds of this group of substances HOECHST AKTIENGESELLSCHAFT (DE) 1998-08-04 US disclosed
EP-0748811-A1 Process for the preparation of hydroxybiarylphosphanes and novel compounds from this materials group HOECHST AKTIENGESELLSCHAFT (DE) 1996-12-18 EP disclosed