SCHEMBL7870174

SCHEMBL7870174

Cc1ccc(Oc2c(F)c(F)c(C#N)c(C#N)c2F)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.50
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
EPAS1 Q99814 2/20 0.34
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C19 P33261 2/20 0.34
AR P10275 8/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 2/20 0.33
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPBWR1 P48145 1/20 0.33
MCHR1 Q99705 1/20 0.33
HTR1A P08908 2/20 0.33
HTR3A P46098 2/20 0.33
MAPT P10636 1/20 0.32
CYP2C9 P11712 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
SCHEMBL7861721 0.81 AR (0.43) MEN1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL2456368 0.79 USP2 (0.40) GAAKMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL7870128 0.78 ALDH1A1 (0.43) GAAMEN1KMT2ACYP1A2CYP3A4
SCHEMBL2453287 0.77 L3MBTL1 (0.43) GAAMEN1KMT2ACYP1A2CYP2C19
SCHEMBL23271200 0.76 GAA (0.50) GAAMEN1KMT2AARKDM4E
SCHEMBL30614642 0.76 GAA (0.50) GAAMEN1KMT2AARKDM4E
SCHEMBL14707042 0.75 SMN1; SMN2 (0.42) GAAMEN1KMT2ACYP1A2CYP3A4
SCHEMBL7870097 0.74 AR (0.42) CYP1A2CYP3A4CYP2C19ARKDM4E
SCHEMBL7870106 0.73 SLC6A3 (0.43) EPAS1HPGDMAPT
SCHEMBL2454805 0.72 USP2 (0.42) GAAKMT2ACYP1A2CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882768-B1 Method for producing of phthalocyanine compound NIPPON CATALYTIC CHEM IND (JP) 2001-12-19 EP disclosed
US-6034236-A REACTING A PHTHALONITRILE WITH A METAL OXIDE IN PRESENCE OF A SULFONIC ACID CATALYST NIPPON SHOKUBAI CO., LTD. (JP) 2000-03-07 US disclosed
EP-0882768-A2 Method for producing of phthalocyanine compound NIPPON SHOKUBAI CO., LTD. (JP) 1998-12-09 EP disclosed