SCHEMBL2456873

SCHEMBL2456873

N#Cc1cccc(Oc2cc(F)c(F)c(Sc3ccccc3)c2)c1C#N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 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
NPSR1 Q6W5P4 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
AR P10275 9/20 0.36
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
PGR P06401 1/20 0.34
FFAR4 Q5NUL3 1/20 0.33
VEGFA P15692 1/20 0.32

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
SCHEMBL2455106 0.90 KDM4E (0.39) KDM4ESMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL2453539 0.89 POLB (0.45) KDM4ESMN1; SMN2MAPTHPGDMEN1
SCHEMBL2453342 0.81 AR (0.40) KDM4ESMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL9747114 0.75 SMN1; SMN2 (0.49) KDM4ESMN1; SMN2ALDH1A1MAPTAR
SCHEMBL2453559 0.74 KDM4E (0.39) KDM4ESMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL28752422 0.74 ALDH1A1 (0.38) KDM4ESMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL669346 0.73 SMN1; SMN2 (0.57) KDM4ESMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL9746873 0.73 SMN1; SMN2 (0.46) KDM4ESMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL9746799 0.73 KDM4E (0.54) KDM4ESMN1; SMN2MAPTARPOLB
SCHEMBL9747018 0.73 KDM4E (0.49) KDM4ESMN1; SMN2MAPTARPOLB

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
EP-1577350-B1 Method for production of halogen-containing phthalocyanine compound NIPPON CATALYTIC CHEM IND (JP) 2011-09-14 EP disclosed
EP-1577350-A1 Method for production of halogen-containing phthalocyanine compound Nippon Shokubai Co., Ltd. (JP) 2005-09-21 EP disclosed