SCHEMBL2454091

SCHEMBL2454091

N#Cc1c(F)c(Sc2ccccc2Cl)c(Sc2ccccc2Cl)c(F)c1C#N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.44
PTGS2 P35354 1/20 0.40
AR P10275 1/20 0.39
HAO1 Q9UJM8 1/20 0.36
RHEB Q15382 1/20 0.35
KMT2A Q03164 2/20 0.34
LMNA P02545 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
MAP2K2 P36507 1/20 0.33
MAP2K1 Q02750 1/20 0.33
LDHA P00338 3/20 0.33
KDM4E B2RXH2 4/20 0.33
MAPT P10636 3/20 0.33
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 1/20 0.33
GALR3 O60755 1/20 0.33
HPGD P15428 1/20 0.33
HIF1A Q16665 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
DYRK1A Q13627 1/20 0.33

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
SCHEMBL2453824 0.93 HSD11B1 (0.42) HSD11B1PTGS2ARHAO1RHEB
SCHEMBL2451807 0.85 HSD11B1 (0.36) HSD11B1PTGS2ARTDP1MAP2K1
SCHEMBL7870046 0.82 KDM4E (0.38) HSD11B1KMT2AKDM4EMAPTALDH1A1
SCHEMBL7869298 0.82 PGR (0.44) ARHAO1KMT2ALMNATDP1
SCHEMBL2456144 0.82 AR (0.39) HSD11B1PTGS2ARKMT2ATDP1
SCHEMBL2453576 0.82 HSD11B1 (0.36) HSD11B1PTGS2KMT2ALMNAKDM4E
SCHEMBL7866675 0.80 ITGB2 (0.44) ARRHEBKMT2ALMNAKDM4E
SCHEMBL7869222 0.79 ALDH1A1 (0.47) ARHAO1KMT2ALMNATDP1
SCHEMBL2458100 0.79 HSD11B1 (0.36) HSD11B1PTGS2ARTDP1MAP2K1
SCHEMBL5090554 0.78 AR (0.50) HSD11B1PTGS2ARHAO1RHEB

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 7 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
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