SCHEMBL7870167

SCHEMBL7870167

N#Cc1c(F)c(F)c(Oc2ccccc2-c2ccccc2)c(F)c1C#N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.45
KDM4E B2RXH2 2/20 0.41
MAPT P10636 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
NCOA1 Q15788 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.41
SQOR Q9Y6N5 4/20 0.40
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ADORA2A P29274 4/20 0.39
ADORA1 P30542 4/20 0.39
SCN9A Q15858 6/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38

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
SCHEMBL7873576 0.81 MAPT (0.46) ARKDM4EMAPTCRHBPCRHR2
SCHEMBL7861721 0.78 AR (0.43) ARKDM4EMAPTCRHBPCRHR2
SCHEMBL7868377 0.78 MAPT (0.43) ARKDM4EMAPTCRHBPCRHR2
SCHEMBL7870170 0.78 MEN1 (0.41) KDM4EMAPTCRHBPCRHR2SQOR
SCHEMBL7106499 0.77 CA12 (0.49) KDM4EMAPTCRHBPCRHR2ALDH1A1
SCHEMBL15257101 0.76 KDM4E (0.41) KDM4EMAPTCRHBPCRHR2SQOR
SCHEMBL29579568 0.76 AR (0.42) ARKDM4EMAPTCRHBPCRHR2
SCHEMBL30511097 0.76 AR (0.42) ARKDM4EMAPTCRHBPCRHR2
SCHEMBL16506206 0.76 AR (0.42) ARKDM4EMAPTCRHBPCRHR2
SCHEMBL7870109 0.72 AR (0.45) ARKDM4EMAPTCRHBPCRHR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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