SCHEMBL2455103

SCHEMBL2455103

N#Cc1c(F)c(Sc2ccccc2)c(Sc2ccccc2)c(Oc2ccccc2)c1C#N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
CYP1A2 P05177 3/20 0.35
CYP2C19 P33261 3/20 0.35
ALDH1A1 P00352 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
CYP2C9 P11712 2/20 0.35
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA7 P43166 2/20 0.34
CA13 Q8N1Q1 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 3/20 0.33
PLA2G1B P04054 1/20 0.33
ATG4B Q9Y4P1 1/20 0.33
KDM4E B2RXH2 2/20 0.32
MAPT P10636 2/20 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
SCHEMBL2456872 0.91 CA12 (0.37) MAOAMAOBMEN1KMT2ACYP1A2
SCHEMBL7106251 0.84 MAOA (0.48) MAOAMAOBMEN1KMT2ACYP1A2
SCHEMBL3888717 0.84 L3MBTL1 (0.36) MAOAMAOBCYP1A2CYP2C19ALDH1A1
SCHEMBL2453341 0.83 MAOA (0.37) MAOAMAOBMEN1KMT2ACYP1A2
SCHEMBL2453537 0.82 LTA4H (0.41) MAOAMAOBMEN1KMT2ACYP1A2
SCHEMBL2451518 0.80 HTR1A (0.33) MAOAMAOBALDH1A1MAPT
SCHEMBL2457184 0.80 ALDH1A1 (0.40) MAOAMAOBMEN1KMT2AALDH1A1
SCHEMBL7869250 0.78 CA12 (0.49) MAOAMAOBMEN1KMT2ACYP1A2
SCHEMBL7103435 0.78 KMT2A (0.44) MAOBMEN1KMT2ACYP1A2CYP2C19
SCHEMBL23417739 0.77 CA12 (0.44) MEN1KMT2ACYP1A2CYP2C19ALDH1A1

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 4 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
US-7473777-B2 Method for production of halogen-containing phthalocyanine compound NIPPON SHOKUBAI CO., LTD. (JP) 2009-01-06 US disclosed
EP-1577350-A1 Method for production of halogen-containing phthalocyanine compound Nippon Shokubai Co., Ltd. (JP) 2005-09-21 EP disclosed
US-20050203293-A1 Method for production of halogen-containing phthalocyanine compound NIPPON SHOKUBAI CO., LTD. (JP) 2005-09-15 US disclosed