SCHEMBL4786958

SCHEMBL4786958

CCCCC(Br)(Br)OCCO

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 3/20 0.33
HSD17B10 Q99714 1/20 0.33
ACHE P22303 1/20 0.33
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
MGLL Q99685 1/20 0.31
USP2 O75604 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPK1 P28482 1/20 0.30
CASP1 P29466 1/20 0.30
SLCO1B3 Q9NPD5 1/20 0.30
SLCO1B1 Q9Y6L6 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
SCHEMBL4301192 0.74 TSHR (0.43) TSHRMEN1KMT2ATHRBHTT
SCHEMBL4934570 0.74 TSHR (0.43) TSHRMEN1KMT2ATHRBHTT
SCHEMBL17553327 0.72 TSHR (0.41) TSHRMEN1KMT2ATHRBHTT
SCHEMBL10535693 0.72 TSHR (0.41) TSHRMEN1KMT2ATHRBHTT
SCHEMBL506335 0.72 TSHR (0.41) TSHRMEN1KMT2ATHRBHTT
SCHEMBL5160043 0.70 TSHR (0.54) TSHRMEN1KMT2ATHRBHTT
SCHEMBL5016480 0.70 MEN1 (0.48) TSHRMEN1KMT2ATHRBHTT
SCHEMBL1734642 0.70 MEN1 (0.48) TSHRMEN1KMT2ATHRBHTT
SCHEMBL5608161 0.70 MEN1 (0.43) TSHRMEN1KMT2ATHRBHTT
SCHEMBL4814730 0.68 MEN1 (0.47) TSHRMEN1KMT2ATHRBHTT

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-20050004277-A1 Halogen-containing flame retardant combination CLARIANT GMBH 2005-01-06 US claimed
JP-1126315-A None JP disclosed
US-20220162366-A1 POLYMERISABLE COMPOSITION FOR BONDING FIBRE UNITS RUDOLF GMBH (DE) 2022-05-26 US disclosed
WO-2008078104-A1 POLYMERS AND THEIR USE AS COATINGS BAXENDEN CHEMICALS LIMITED (GB) 2008-07-03 WO disclosed
US-6100363-A POLYURETHANE BASED ENERGY ABSORBING ELASTOMERS USEFUL FOR COATING LARGE OBJECTS FILLING A VOID BETWEEN TWO SUBSTRATES, AND WHERE MOISTURE RESISTANCE IS AN IMPORTANT CONSIDERATION BASF CORPORATION (US) 2000-08-08 US disclosed
JP-H01126315-A PRODUCTION OF FLAME-RETARDANT UNSATURATED POLYESTER AND FLAME-RETARDANT UNSATURATED POLYESTER RESIN HITACHI CHEM CO LTD 1989-05-18 JP disclosed
US-4377653-A Mixed ether compositions containing oligomers of polyfunctional phosphine oxides: flame retardants for polymers FMC CORPORATION (US) 1983-03-22 US disclosed
US-4042550-A Encapsulant compositions based on anhydride-hardened epoxy resins ALLIED CHEMICAL CORPORATION (US) 1977-08-16 US disclosed