SCHEMBL2457570

SCHEMBL2457570

N#Cc1cccc(Nc2cc(F)c(Sc3cc(Cl)ccc3Cl)c(Sc3cc(Cl)ccc3Cl)c2)c1C#N

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
TAS1R2 Q8TE23 1/20 0.37
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
RHEB Q15382 1/20 0.32
LRRK2 Q5S007 1/20 0.32
PLA2G1B P04054 1/20 0.30
ATM Q13315 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ATG4B Q9Y4P1 1/20 0.30
MAP2K1 Q02750 1/20 0.30
GLA P06280 1/20 0.30

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
SCHEMBL2453569 0.91 ALDH1A1 (0.34) TAS1R3TAS1R1TAS1R2KDM4EALDH1A1
SCHEMBL2451810 0.90 HSD11B1 (0.34) TAS1R3TAS1R1TAS1R2KDM4EALDH1A1
SCHEMBL2454943 0.83 TAS1R3 (0.35) TAS1R3TAS1R1TAS1R2KDM4EALDH1A1
SCHEMBL2458103 0.80 HSD11B1 (0.34) TAS1R3TAS1R1TAS1R2KDM4EALDH1A1
SCHEMBL2456522 0.80 HSD11B1 (0.35) KDM4EALDH1A1GAAALOX15HSD17B10
SCHEMBL2453616 0.80 KDM4E (0.38) KDM4EALDH1A1GAALRRK2NPSR1
SCHEMBL2453844 0.76 KDM4E (0.36) TAS1R3TAS1R1TAS1R2KDM4EALDH1A1
SCHEMBL6218942 0.75 KDM4E (0.39) KDM4EALDH1A1GAANPSR1
SCHEMBL2452184 0.74 KDM4E (0.37) TAS1R3TAS1R1TAS1R2KDM4EALDH1A1
SCHEMBL2453579 0.73 KDM4E (0.38) TAS1R3TAS1R1TAS1R2KDM4EHSD17B10

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