SCHEMBL4756689

SCHEMBL4756689

CC(C=CC(=O)O)C(Oc1ccccc1Br)Oc1ccccc1Br

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
TSHR P16473 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
LY96 Q9Y6Y9 1/20 0.38
KDM4E B2RXH2 1/20 0.38
KMT2A Q03164 1/20 0.37
HTR1A P08908 1/20 0.37
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTT P42858 1/20 0.36
GAA P10253 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
HDAC4 P56524 1/20 0.35
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34

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
SCHEMBL4758988 0.79 HCAR2 (0.44) LMNAHCAR2KMT2AALDH1A1HPGD
SCHEMBL4756679 0.75 HSD17B10 (0.45) LMNAHCAR2KDM4EKMT2AALDH1A1
SCHEMBL4756681 0.75 HSD17B10 (0.45) LMNAHCAR2KDM4EKMT2AALDH1A1
SCHEMBL12635150 0.74 KMT2A (0.66) LMNATSHRKMT2AHTR1AADRA2A
SCHEMBL31108006 0.74 KMT2A (0.66) LMNATSHRKMT2AHTR1AADRA2A
SCHEMBL4093439 0.70 HTR1A (0.47) LMNATSHRLY96KMT2AHTR1A
SCHEMBL8037990 0.70 LMNA (0.52) LMNATSHRKMT2AHTR1AADRA2A
SCHEMBL17204784 0.70 KMT2A (0.55) LMNAHCAR2KDM4EKMT2AALDH1A1
SCHEMBL14783602 0.69 LMNA (0.51) LMNATSHRKDM4EKMT2AHTR1A
SCHEMBL17386433 0.69 HTR1A (0.46) LMNATSHRLY96KMT2AHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008073534-A1 METAL OXIDE AND SULFUR-CONTAINING COATING COMPOSITIONS, METHODS OF USE, AND ARTICLES PREPARED THEREFROM GENERAL ELECTRIC COMPANY (US) 2008-06-19 WO disclosed