SCHEMBL7873517

SCHEMBL7873517

N#Cc1c(F)c(Sc2ccc(Cl)cc2)c(Sc2ccc(Cl)cc2)c(F)c1C#N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.53
MAOB P27338 5/20 0.53
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
CYP1A2 P05177 4/20 0.41
CYP2C19 P33261 4/20 0.41
KDM4E B2RXH2 4/20 0.41
MAPT P10636 3/20 0.41
CYP3A4 P08684 3/20 0.41
HPGD P15428 3/20 0.41
CYP2D6 P10635 2/20 0.41
ALDH1A1 P00352 3/20 0.40
CYP2C9 P11712 3/20 0.40
PTGDR2 Q9Y5Y4 2/20 0.40
AKR1B1 P15121 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36

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
SCHEMBL7870136 0.85 CYP1A2 (0.41) MAOAMAOBMEN1KMT2ACYP1A2
SCHEMBL7870102 0.81 L3MBTL1 (0.42) MAOAMAOBMEN1KMT2ACYP1A2
SCHEMBL7106251 0.81 MAOA (0.48) MAOAMAOBMEN1KMT2ACYP1A2
SCHEMBL7866675 0.76 ITGB2 (0.44) MEN1KMT2ACYP1A2CYP2C19KDM4E
SCHEMBL7870046 0.74 KDM4E (0.38) MEN1KMT2ACYP1A2CYP2C19KDM4E
SCHEMBL7869250 0.74 CA12 (0.49) MAOAMAOBMEN1KMT2ACYP1A2
SCHEMBL1154522 0.73 MAOA (0.47) MAOAMAOBMEN1KMT2ACYP1A2
SCHEMBL2454091 0.71 HSD11B1 (0.44) MEN1KMT2ACYP1A2CYP2C19KDM4E
SCHEMBL5788515 0.70 MAOB (1.00) MAOAMAOBMEN1KMT2ACYP1A2
SCHEMBL15536328 0.69 MAOA (0.50) MAOAMAOBMEN1KMT2ACYP1A2

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