SCHEMBL2454943

SCHEMBL2454943

N#Cc1cccc(NCc2cc(F)c(Sc3cc(Cl)ccc3Cl)c(Sc3cc(Cl)ccc3Cl)c2)c1C#N

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
KDM4E B2RXH2 2/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP2D6 P10635 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
NOS2 P35228 1/20 0.32
PLA2G1B P04054 1/20 0.31
ATM Q13315 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ATG4B Q9Y4P1 1/20 0.31
RHEB Q15382 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL2453844 0.91 KDM4E (0.36) TAS1R3TAS1R1TAS1R2KDM4EHPGD
SCHEMBL2453579 0.90 KDM4E (0.38) TAS1R3TAS1R1TAS1R2KDM4EHPGD
SCHEMBL2457570 0.83 TAS1R3 (0.37) TAS1R3TAS1R1TAS1R2KDM4EHSD17B10
SCHEMBL2453767 0.81 KDM4E (0.39) TAS1R3TAS1R1TAS1R2KDM4EHPGD
SCHEMBL2455401 0.81 KDM4E (0.43) KDM4EHPGDTSHRHSD17B10NPSR1
SCHEMBL2460042 0.81 HPGD (0.40) KDM4EHPGDTSHRHSD17B10ALDH1A1
SCHEMBL2453472 0.76 MEN1 (0.36) KDM4EHPGDTSHRHSD17B10NPSR1
SCHEMBL2453569 0.76 ALDH1A1 (0.34) TAS1R3TAS1R1TAS1R2KDM4EHPGD
SCHEMBL2456356 0.75 KDM4E (0.43) KDM4EHPGDTSHRHSD17B10ALDH1A1
SCHEMBL2451810 0.73 HSD11B1 (0.34) TAS1R3TAS1R1TAS1R2KDM4ETSHR

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