SCHEMBL6439716

SCHEMBL6439716

[CH2]C(O)COc1c(Br)cc(Br)c(C)c1Br

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRA P10827 2/20 0.35
THRB P10828 2/20 0.35
ALDH1A1 P00352 1/20 0.34
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
TSHR P16473 1/20 0.32
ATM Q13315 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
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
SCHEMBL9319827 0.78 TSHR (0.48) THRATHRBALDH1A1TSHRMEN1
SCHEMBL10607524 0.76 TSHR (0.39) THRATHRBTSHRLMNASMN1; SMN2
SCHEMBL10607568 0.76 TSHR (0.39) THRATHRBTSHRLMNASMN1; SMN2
SCHEMBL2688149 0.75 ALDH1A1 (0.62) THRATHRBALDH1A1TSHRATM
SCHEMBL10632415 0.73
SCHEMBL10606972 0.72 THRA (0.32) THRATHRB
SCHEMBL6440253 0.72 KMT2A (0.33) ALDH1A1ATMMEN1LMNAKMT2A
SCHEMBL29726739 0.69 CA2 (0.60) ALDH1A1CA2CA4TSHRMEN1
SCHEMBL9635966 0.69 CA2 (0.60) ALDH1A1CA2CA4TSHRMEN1
SCHEMBL18762038 0.68 ALDH1A1 (0.54) THRATHRBALDH1A1TSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1474719-A4 POLYMERIZATION PROCESS AND MATERIALS FOR BIOMEDICAL APPLICATIONS ZMS LLC (US) 2005-12-14 EP claimed
US-20050090612-A1 Polymerization process and materials for biomedical applications ZMS, L.L.C.; A CALIFORNIA LIMITED LIABILITY CORPORATION 2005-04-28 US claimed
EP-1474719-A1 POLYMERIZATION PROCESS AND MATERIALS FOR BIOMEDICAL APPLICATIONS ZMS, LLC (US) 2004-11-10 EP claimed
WO-2003071339-A1 POLYMERIZATION PROCESS AND MATERIALS FOR BIOMEDICAL APPLICATIONS ZMS, LLC (US) 2003-08-28 WO claimed
EP-1474719-A4 POLYMERIZATION PROCESS AND MATERIALS FOR BIOMEDICAL APPLICATIONS ZMS LLC (US) 2005-12-14 EP disclosed
US-20050090612-A1 Polymerization process and materials for biomedical applications ZMS, L.L.C.; A CALIFORNIA LIMITED LIABILITY CORPORATION 2005-04-28 US disclosed
EP-1474719-A1 POLYMERIZATION PROCESS AND MATERIALS FOR BIOMEDICAL APPLICATIONS ZMS, LLC (US) 2004-11-10 EP disclosed
WO-2003071339-A1 POLYMERIZATION PROCESS AND MATERIALS FOR BIOMEDICAL APPLICATIONS ZMS, LLC (US) 2003-08-28 WO disclosed
US-4487904-A Urethanized acrylic resin material for plastic lens and lens composed thereof TORAY INDUSTRIES, INC. (JP) 1984-12-11 US disclosed