SCHEMBL3205462

SCHEMBL3205462

O=c1c2ccccc2sc2c(C(Cl)Cl)cccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
MAPT P10636 5/20 0.44
ALDH1A1 P00352 5/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 2/20 0.44
POLB P06746 2/20 0.44
HCRTR1 O43613 2/20 0.44
CYP19A1 P11511 1/20 0.43
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPK1 P28482 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SAE1 Q9UBE0 1/20 0.39
UBA2 Q9UBT2 1/20 0.39
GPR3 P46089 1/20 0.38

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
SCHEMBL29398001 0.83 MAPT (0.48) KDM4EMAPTALDH1A1L3MBTL1LMNA
SCHEMBL108905 0.83 MAPT (0.48) KDM4EMAPTALDH1A1L3MBTL1LMNA
SCHEMBL16697721 0.83 MAPT (0.43) KDM4EMAPTALDH1A1L3MBTL1LMNA
Cycloheptane SCHEMBL23089052 0.80 MAPT (0.44) KDM4EMAPTALDH1A1L3MBTL1LMNA
SCHEMBL18434812 0.77 MAPT (0.47) KDM4EMAPTALDH1A1L3MBTL1LMNA
SCHEMBL150108 0.77 KDM4E (0.54) KDM4EMAPTALDH1A1L3MBTL1LMNA
SCHEMBL1821428 0.75 KDM4E (0.68) KDM4EMAPTALDH1A1L3MBTL1LMNA
Propionaldehyde SCHEMBL8326892 0.75 CYP19A1 (0.43) KDM4EMAPTALDH1A1L3MBTL1LMNA
SCHEMBL9851949 0.74 ALDH1A1 (0.47) KDM4EMAPTALDH1A1L3MBTL1LMNA
SCHEMBL8813719 0.74 ALDH1A1 (0.47) KDM4EMAPTALDH1A1L3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100047451-A1 ACTINIC-RADIATION CURABLE INK COMPOSITION, INK SET, INK JET PRINTING APPARATUS, AND INK JET RECORDING METHOD USING ACTINIC-RADIATION CURABLE INK COMPOSITION SEIKO EPSON CORPORATION 2010-02-25 US disclosed
CN-101550295-A Active ray solidification type ink composition and combined ink using the ink component, ink jet printing device and ink jet recording method SEIKO EPSON CORP (JP) 2009-10-07 CN disclosed