SCHEMBL258076

SCHEMBL258076

Cc1cccc(-c2ccccc2)c1Oc1c(C)cccc1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.47
CD274 Q9NZQ7 1/20 0.47
SCN8A Q9UQD0 1/20 0.46
ESR2 Q92731 1/20 0.44
ALDH1A1 P00352 4/20 0.43
HPGD P15428 3/20 0.43
HSD17B10 Q99714 2/20 0.43
BCL2L1 Q07817 1/20 0.43
CYP2A6 P11509 1/20 0.42
CYP2B6 P20813 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MYC P01106 1/20 0.41
FGFR1 P11362 1/20 0.41
FGFR2 P21802 1/20 0.41
FGFR4 P22455 1/20 0.41
FGFR3 P22607 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL14176639 0.85 SCN8A (0.45) PDCD1CD274SCN8AALDH1A1HPGD
SCHEMBL854412 0.84 ALDH1A1 (0.46) PDCD1CD274ALDH1A1HPGDHSD17B10
SCHEMBL180120 0.83 SMN1; SMN2 (0.47) PDCD1CD274SCN8AALDH1A1HPGD
SCHEMBL17720733 0.81 L3MBTL1 (0.50) PDCD1CD274SCN8AALDH1A1HPGD
SCHEMBL29997299 0.80 SCN8A (0.49) PDCD1CD274SCN8AALDH1A1HPGD
SCHEMBL17897357 0.80 SCN8A (0.42) PDCD1CD274SCN8AESR2ALDH1A1
SCHEMBL4137100 0.80 SCN8A (0.40) PDCD1CD274SCN8AESR2ALDH1A1
SCHEMBL4131775 0.80 FGFR1 (0.40) PDCD1CD274SCN8AESR2ALDH1A1
SCHEMBL10901422 0.80 INPPL1 (0.46) PDCD1CD274SCN8AALDH1A1HPGD
SCHEMBL27563693 0.80 SCN8A (0.40) PDCD1CD274SCN8AESR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8063123-B2 Phosphorus-containing mixtures, a process for their preparation and their use CLARIANT FINANCE (BVI) LIMITED (VG) 2011-11-22 US disclosed
US-7820850-B2 Phosphorus-containing mixtures, a process for their preparation and their use CLARIANT FINANCE (BVI) LIMITED (VG) 2010-10-26 US disclosed
US-7655715-B2 Phosphorus-containing mixtures, a process for their preparation and their use CLARIANT FINANCE (BVI) LIMITED (VG) 2010-02-02 US disclosed
US-20070224421-A1 Phosphorus-containing mixtures, a process for their preparation and their use CLARIANT INTERNATIONAL LTD 2007-09-27 US disclosed
US-20070221893-A1 thermosetting; fireproofing CLARIANT INTERNATIONAL LTD. 2007-09-27 US disclosed
US-20070225414-A1 Phosphorus-containing mixtures, a process for their preparation and their use CLARIANT INTERNATIONAL LTD 2007-09-27 US disclosed