SCHEMBL2458090

SCHEMBL2458090

Cc1ccc(Nc2c(F)c(F)c(C#N)c(C#N)c2F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
DHODH Q02127 4/20 0.46
GAA P10253 2/20 0.43
RAPGEF4 Q8WZA2 1/20 0.43
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
EGFR P00533 1/20 0.37
ERBB2 P04626 1/20 0.37
THRB P10828 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
G6PD P11413 1/20 0.37

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
SCHEMBL2454986 0.93 DHODH (0.49) MEN1KMT2ASMN1; SMN2DHODHGAA
SCHEMBL14318533 0.88 MEN1 (0.46) MEN1KMT2ASMN1; SMN2DHODHGAA
SCHEMBL2453587 0.86 DHODH (0.46) MEN1KMT2ASMN1; SMN2DHODHGAA
SCHEMBL7868431 0.83 MAPT (0.44) MEN1KMT2ADHODHGAAMAPT
SCHEMBL3963873 0.82 ADORA1 (0.44) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL2460760 0.82 HTT (0.49) KMT2ASMN1; SMN2GAAMAPTALDH1A1
SCHEMBL7712954 0.80 DHODH (0.41) MEN1KMT2ASMN1; SMN2DHODHGAA
SCHEMBL14318534 0.78 DHODH (0.46) MEN1KMT2ASMN1; SMN2DHODHGAA
SCHEMBL2455088 0.78 RAPGEF4 (0.53) MEN1KMT2ASMN1; SMN2RAPGEF4ALDH1A1
SCHEMBL7869295 0.76 NRP1 (0.39) MEN1KMT2ASMN1; SMN2DHODHRAPGEF4

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