SCHEMBL28021871

SCHEMBL28021871

CC(=O)C(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
POLB P06746 1/20 0.47
MIF P14174 1/20 0.47
TSHR P16473 2/20 0.44
MAPK1 P28482 1/20 0.44
HIF1A Q16665 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
BRD4 O60885 1/20 0.42
ALOX15 P16050 1/20 0.41
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL13427606 0.90 KCNN4 (0.52) MEN1KMT2APOLBMIFMAPK1
SCHEMBL3413489 0.79 MEN1 (0.54) MEN1KMT2APOLBMIFTSHR
SCHEMBL4591880 0.78 MIF (0.54) MEN1KMT2APOLBMIFTSHR
SCHEMBL11303263 0.77 KMT2A (0.58) MEN1KMT2APOLBMIFTSHR
SCHEMBL13427572 0.76 KCNN4 (0.61) MEN1KMT2APOLBMAPK1NPC1
1,4-Dichlorobenzene SCHEMBL76049 0.73 ALOX15 (0.60) MEN1KMT2AMIFTSHRMAPK1
Acetic Acid SCHEMBL2528773 0.73 NR4A1 (0.52) MEN1KMT2AMIFCES2CES1
SCHEMBL3410686 0.73 MEN1 (0.47) MEN1KMT2APOLBMIFTSHR
SCHEMBL4437287 0.73 MEN1 (0.47) MEN1KMT2APOLBMIFTSHR
SCHEMBL8160579 0.71 MEN1 (0.56) MEN1KMT2APOLBMIFTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102666469-B Novel noncrystalline methacrylates, their preparation and use BAYER MATERIALSCIENCE AG (DE) 2016-03-02 CN disclosed
CN-102667935-B Photopolymer formulation with different writing comonomers BAYER MATERIALSCIENCE AG (DE) 2016-01-20 CN disclosed
CN-102870157-B Method for producing holographic film BAYER MATERIALSCIENCE AG (DE) 2016-01-20 CN disclosed
CN-105122368-A Protective lacquers and adhesives based on acrylate BAYER MATERIALSCIENCE AG 2015-12-02 CN disclosed
CN-104892462-A Novel noncrystalline methacrylates, their preparation and use BAYER MATERIALSCIENCE AG 2015-09-09 CN disclosed
CN-104685504-A Method for selecting photoinitiator system BAYER MATERIALSCIENCE AG 2015-06-03 CN disclosed