SCHEMBL8611708

SCHEMBL8611708

Oc1ccc2ccccc2c1-c1ccccc1P(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 6/20 0.49
HSP90AB1 P08238 6/20 0.49
L3MBTL1 Q9Y468 3/20 0.43
MAPT P10636 2/20 0.43
MAPK1 P28482 2/20 0.43
THRB P10828 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
NSD2 O96028 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
HKDC1 Q2TB90 1/20 0.41
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPC1 O15118 2/20 0.38
PTPN22 Q9Y2R2 1/20 0.38
RAB9A P51151 1/20 0.38
CHEK1 O14757 1/20 0.36
CDK8 P49336 1/20 0.36
NEK2 P51955 1/20 0.36
LIMK1 P53667 1/20 0.36

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
SCHEMBL8611516 0.88 NSD2 (0.44) HSP90AA1HSP90AB1THRBNSD2OPRM1
SCHEMBL8613188 0.83 HSP90AA1 (0.44) HSP90AA1HSP90AB1L3MBTL1MAPTMAPK1
Dimethylamine SCHEMBL8611687 0.83 HSP90AA1 (0.41) HSP90AA1HSP90AB1MAPTNSD2OPRM1
SCHEMBL8611685 0.83 RRM1 (0.43) HSP90AA1HSP90AB1L3MBTL1MAPTTDP1
SCHEMBL30595038 0.81 CYP1B1 (0.38) HSP90AA1HSP90AB1L3MBTL1MAPTMAPK1
SCHEMBL30595046 0.79 MAPK13 (0.37) L3MBTL1MAPTMAPK1THRBTDP1
SCHEMBL8613773 0.79 P2RX1 (0.39) HSP90AA1HSP90AB1L3MBTL1MAPTTHRB
SCHEMBL1305632 0.79 CES1 (0.40) HSP90AA1HSP90AB1L3MBTL1MAPTMAPK1
SCHEMBL7796060 0.78 DNMT1 (0.36) HSP90AA1HSP90AB1L3MBTL1MAPTMAPK1
SCHEMBL8612267 0.77 HSP90AA1 (0.40) 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