SCHEMBL2455264

SCHEMBL2455264

COc1cc(Cl)c(Sc2ccccc2)c(Sc2ccccc2)c1Nc1cccc(C#N)c1C#N

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SRC P12931 12/20 0.42
AR P10275 2/20 0.39
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CLCN2 P51788 1/20 0.35
EGFR P00533 1/20 0.35
ERBB2 P04626 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35

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
SCHEMBL2454724 0.88 AR (0.39) SRCARMAPTMEN1TSHR
SCHEMBL2455263 0.84 AR (0.35) SRCARMAPTALDH1A1GAA
SCHEMBL3903063 0.75 POLB (0.40) SRCMAPTALDH1A1GAAHPGD
SCHEMBL2454722 0.74 JAK1 (0.36) ARMAPTALDH1A1HPGDMEN1
SCHEMBL2460050 0.73 MAPT (0.45) ARMAPTALDH1A1GAAHPGD
SCHEMBL3901476 0.70 POLB (0.40) ARMAPTALDH1A1GAAHPGD
SCHEMBL2456356 0.69 KDM4E (0.43) MAPTALDH1A1GAAHPGDMEN1
SCHEMBL15535395 0.69 AR (0.48) ARMAPTALDH1A1GAAHPGD
SCHEMBL2453342 0.68 AR (0.40) ARMAPTALDH1A1GAAHPGD
SCHEMBL2453616 0.68 KDM4E (0.38) ARMAPTALDH1A1GAAHPGD

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