SCHEMBL7598077

SCHEMBL7598077

C=CCOc1c(Br)cc(Cc2cc(Br)c(OCC=C)c(Br)c2)cc1Br

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 4/20 0.42
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
HPGD P15428 2/20 0.39
MAPT P10636 4/20 0.38
GAA P10253 3/20 0.38
HTT P42858 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
THRB P10828 1/20 0.36
TSHR P16473 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
BLM P54132 1/20 0.35

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
SCHEMBL10712071 0.85 HRH3 (0.44) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL42433 0.83 LMNA (0.45) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL7600877 0.83 LMNA (0.45) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL4378900 0.82 LMNA (0.46) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL8373812 0.81 LMNA (0.38) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL6578128 0.80 LMNA (0.47) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL10887119 0.77 THRB (0.40) SMN1; SMN2ALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL10338842 0.76 LMNA (0.43) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL10500362 0.76 CA12 (0.45) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL4140521 0.76 HRH3 (0.39) KMT2AMEN1THRBCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0913381-B1 Method for purifying a bromine compound TEIJIN CHEMICALS LTD (JP) 2002-12-11 EP disclosed
US-6333437-B1 SUPPLYING CRUDE SOLUTION AND POOR SOLVENT FOR BROMINE COMPOUND INTO VESSEL CONTAINING SLURRY OF PARTICLES OF BROMINE COMPOUND TO DEPOSIT PARTICLES IN SLURRY UNDER AGITATION, EXTRACTING SLURRY FROM VESSEL, SEPARATING SOLID PARTICLES TEIJIN CHEMICALS LTD (JP) 2001-12-25 US disclosed
US-5998674-A BROMINATING AN UNSATURATED BOND; HEAT GENERATED BY REACTION IS USED TO VAPORIZE SOLVENT TEIJIN CHEMICALS, LTD. (JP) 1999-12-07 US disclosed
EP-0899254-A2 Bromine compound production method Teijin Chemicals, Ltd. (JP) 1999-03-03 EP disclosed