SCHEMBL6238946

SCHEMBL6238946

CC(C)C(OC(=O)c1cccc(-c2ccccc2)c1Oc1c(F)c(F)c(C#N)c(C#N)c1F)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 2/20 0.41
SCN2A Q99250 2/20 0.41
SCN3A Q9NY46 2/20 0.41
ALDH1A1 P00352 3/20 0.34
LMNA P02545 2/20 0.34
PLA2G1B P04054 2/20 0.34
ATG4B Q9Y4P1 2/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
CRHBP P24387 1/20 0.34
MAPK1 P28482 1/20 0.34
CRHR2 Q13324 1/20 0.34
NPC1 O15118 1/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KMT2A Q03164 1/20 0.33
SCN9A Q15858 1/20 0.33
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32

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
SCHEMBL7866640 0.92 SCN1A (0.42) SCN1ASCN2ASCN3AALDH1A1LMNA
SCHEMBL7868307 0.89 SCN1A (0.40) SCN1ASCN2ASCN3AALDH1A1LMNA
SCHEMBL7870038 0.87 SCN1A (0.41) SCN1ASCN2ASCN3AALDH1A1LMNA
SCHEMBL7866652 0.87 SCN1A (0.39) SCN1ASCN2ASCN3AALDH1A1LMNA
SCHEMBL7868391 0.87 SCN1A (0.43) SCN1ASCN2ASCN3AALDH1A1LMNA
SCHEMBL7868297 0.85 SCN1A (0.40) SCN1ASCN2ASCN3AALDH1A1LMNA
SCHEMBL7866657 0.84 SCN1A (0.39) SCN1ASCN2ASCN3AALDH1A1LMNA
SCHEMBL7868300 0.82 SCN1A (0.39) SCN1ASCN2ASCN3A
SCHEMBL6238950 0.82 ALDH1A1 (0.37) SCN1ASCN2ASCN3AALDH1A1LMNA
SCHEMBL7866643 0.82 SCN1A (0.45) SCN1ASCN2ASCN3AALDH1A1LMNA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0889097-B1 PHTHALOCYANINE COMPOUNDS, PROCESS FOR PREPARING THE SAME, AND OPTICAL RECORDING MEDIUM MADE USING THE SAME NIPPON CATALYTIC CHEM IND (JP) 2005-06-29 EP 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
US-5998609-A OPTICAL RECORDING MEDIA NIPPON SHOKUBAI CO., LTD. (JP) 1999-12-07 US disclosed
EP-0889097-A1 PHTHALOCYANINE COMPOUNDS, PROCESS FOR PREPARING THE SAME, AND OPTICAL RECORDING MEDIUM MADE USING THE SAME NIPPON SHOKUBAI CO., LTD. (JP) 1999-01-07 EP disclosed
EP-0882768-A2 Method for producing of phthalocyanine compound NIPPON SHOKUBAI CO., LTD. (JP) 1998-12-09 EP disclosed