SCHEMBL2453569

SCHEMBL2453569

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

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
GAA P10253 2/20 0.34
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RHEB Q15382 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 1/20 0.32
MAP2K1 Q02750 1/20 0.32
GLA P06280 1/20 0.32
CYP2D6 P10635 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
NOS2 P35228 1/20 0.31
HPGD P15428 1/20 0.31
CYP2A6 P11509 1/20 0.30
SRC P12931 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
SCHEMBL2457570 0.91 TAS1R3 (0.37) ALDH1A1KDM4EGAAALOX15HSD17B10
SCHEMBL2456522 0.89 HSD11B1 (0.35) ALDH1A1KDM4EGAAALOX15HSD17B10
SCHEMBL2453844 0.82 KDM4E (0.36) ALDH1A1KDM4EGAAALOX15HSD17B10
SCHEMBL2451810 0.80 HSD11B1 (0.34) ALDH1A1KDM4EGAAALOX15HSD17B10
SCHEMBL2460050 0.77 MAPT (0.45) ALDH1A1KDM4EGAAHSD17B10HPGD
SCHEMBL2454943 0.76 TAS1R3 (0.35) ALDH1A1KDM4EHSD17B10RHEBTAS1R3
SCHEMBL2458103 0.74 HSD11B1 (0.34) ALDH1A1KDM4EGAAALOX15HSD17B10
SCHEMBL2456434 0.72 AR (0.34) ALDH1A1KDM4EGAAALOX15HSD17B10
SCHEMBL2460042 0.71 HPGD (0.40) ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL27622769 0.69 ADORA2A (0.39) ALDH1A1KDM4EGAAALOX15RHEB

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