SCHEMBL1140477

SCHEMBL1140477

CCCCCB(CCCCC)OCCCC

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
TSHR P16473 3/20 0.35
THRB P10828 2/20 0.35
CYP3A4 P08684 1/20 0.33
ALDH1A1 P00352 1/20 0.32
ANPEP P15144 1/20 0.32
CA1 P00915 3/20 0.31
CA2 P00918 3/20 0.31
NR5A1 Q13285 1/20 0.30
CA9 Q16790 2/20 0.30
LMNA P02545 1/20 0.30
ATM Q13315 1/20 0.30
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
CA12 O43570 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL4263648 0.95 THRB (0.35) TSHRTHRBCA1CA2CA9
SCHEMBL1017192 0.92 ANPEP (0.39) ADRB2ADRB1ADRB3TSHRTHRB
SCHEMBL27008263 0.90 TSHR (0.35) ADRB2ADRB1ADRB3TSHRTHRB
SCHEMBL8966928 0.87 THRB (0.40) TSHRTHRBANPEPCA1CA2
SCHEMBL8966564 0.86 ADRB2 (0.39) ADRB2ADRB1ADRB3TSHRTHRB
SCHEMBL4274136 0.84 THRB (0.35) TSHRTHRBCA1CA2CA9
SCHEMBL8967089 0.82 THRB (0.40) TSHRTHRBCA1CA2CA9
SCHEMBL8966224 0.81 TSHR (0.37) TSHRTHRBANPEPLMNAMEN1
SCHEMBL4261185 0.81 ANPEP (0.39) ADRB2ADRB1ADRB3TSHRTHRB
SCHEMBL8966752 0.81 ADRB2 (0.39) ADRB2ADRB1ADRB3TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1765358-B1 TREATMENT OR PREVENTION OF SKIN CONDITIONS OR TISSUE CONDITIONS IN ANIMALS USING BORYLOXYPYRIDYLMETHANONES ANACOR PHARMACEUTICALS INC (US) 2011-02-23 EP disclosed
EP-0519496-B1 Thermosetting copolymers, silicon carbide-based fiber and processes for producing same TONEN CORP (JP) 1996-05-22 EP disclosed
EP-0404503-B1 Boron-containing, silicon nitride-based ceramic shaped body production process TONEN CORP (JP) 1996-03-06 EP disclosed
EP-0389084-B1 Process for producing a polyborosilazane TONEN CORP (JP) 1995-09-20 EP disclosed
US-5292830-A Silane, silazane, boron block crosslinked copolymers TONEN CORPORATION (JP) 1994-03-08 US disclosed
EP-0519496-A1 Thermosetting copolymers, silicon carbide-based fiber and processes for producing same Tonen Corporation (JP) 1992-12-23 EP disclosed
US-5128286-A BORON-CONTAINING, SILICON NITRIDE-BASED CERAMIC SHAPED BODY TONEN CORPORATION (JP) 1992-07-07 US disclosed
US-5030744-A Polyborosilazane and process for producing same TONEN CORPORATION (JP) 1991-07-09 US disclosed
EP-0404503-A1 Boron-containing, silicon nitride-based ceramic shaped body production process Tonen Corporation (JP) 1990-12-27 EP disclosed
EP-0389084-A2 Process for producing a polyborosilazane Tonen Corporation (JP) 1990-09-26 EP disclosed