SCHEMBL4175974

SCHEMBL4175974

c1ccc(-c2ccccc2OB(Oc2ccccc2-c2ccccc2)Oc2ccccc2-c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.47
TP53 P04637 1/20 0.47
RAB9A P51151 1/20 0.47
NCOA1 Q15788 1/20 0.47
NCOA3 Q9Y6Q9 1/20 0.47
HRH1 P35367 1/20 0.44
HTR7 P34969 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ADRB2 P07550 4/20 0.42
ALDH1A1 P00352 4/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41
BCL2L1 Q07817 1/20 0.41
CYP2A6 P11509 1/20 0.41
ADRB1 P08588 2/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
LMNA P02545 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
SCHEMBL30725510 0.82 TDP1 (0.44) MAPK1TP53RAB9ANCOA1NCOA3
SCHEMBL960732 0.82 TDP1 (0.44) MAPK1TP53RAB9ANCOA1NCOA3
SCHEMBL112422 0.77 NCOA1 (0.63) MAPK1TP53RAB9ANCOA1NCOA3
SCHEMBL10756496 0.75 NCOA1 (0.61) MAPK1TP53RAB9ANCOA1NCOA3
Hydrogen Sulfide SCHEMBL27922694 0.75 NCOA1 (0.61) MAPK1TP53RAB9ANCOA1NCOA3
SCHEMBL28436320 0.75 NCOA1 (0.61) MAPK1TP53RAB9ANCOA1NCOA3
SCHEMBL6321993 0.75 NCOA1 (0.61) MAPK1TP53RAB9ANCOA1NCOA3
SCHEMBL28431579 0.75 NCOA1 (0.61) MAPK1TP53RAB9ANCOA1NCOA3
SCHEMBL714015 0.73 MAPK1 (0.48) MAPK1TP53RAB9ANCOA1NCOA3
SCHEMBL3998875 0.73 NCOA1 (0.53) MAPK1TP53RAB9ANCOA1NCOA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069271-A1 WOOD TREATMENT STANIMIROFF IVAN LAURENCE 2009-03-12 US disclosed
EP-1945424-A1 WOOD TREATMENT Stanimiroff, Ivan Laurence (NZ) 2008-07-23 EP disclosed
WO-2007055601-A1 WOOD TREATMENT STANIMIROFF IVAN LAURENCE (NZ) 2007-05-18 WO disclosed
US-4281173-A Preparation of unsaturated diesters by catalytic oxidative carbonylation of diolefins ATLANTIC RICHFIELD COMPANY (US) 1981-07-28 US disclosed
US-4195184-A Preparation of unsaturated monoesters by catalytic oxidative carbonylation of diolefins ATLANTIC RICHFIELD COMPANY (US) 1980-03-25 US disclosed
US-4189599-A Preparation of dimethyl adipate by the hydrogenation of dimethyl hex-3-endioate ATLANTIC RICHFIELD COMPANY (US) 1980-02-19 US disclosed
US-4171450-A Preparation of unsaturated diesters by catalytic oxidative carbonylation of diolefins ATLANTIC RICHFIELD COMPANY (US) 1979-10-16 US disclosed
US-4041068-A AS CATALYST A PALLADIUM, PLATINUM OR RHODIUM SALT WITH AN AMINE AND AN ALCOHOL ATLANTIC RICHFIELD COMPANY (US) 1977-08-09 US disclosed