SCHEMBL18174765

SCHEMBL18174765

Cc1cncc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5cccnc5C)cc4)c4ccccc34)c3ccccc23)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.44
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
APLNR P35414 1/20 0.39
COMT P21964 1/20 0.39
PTGS2 P35354 5/20 0.37
PTGS1 P23219 2/20 0.37
TDO2 P48775 1/20 0.36
CKS1B P61024 4/20 0.34
SKP2 Q13309 4/20 0.34
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 0.34
CYP2A6 P11509 1/20 0.34
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
GLO1 Q04760 2/20 0.33
METAP2 P50579 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
SCHEMBL18174700 0.91 DHODH (0.44) DHODHMKNK1MKNK2APLNRCOMT
SCHEMBL18174751 0.90 DHODH (0.39) DHODHMKNK1MKNK2APLNRCOMT
SCHEMBL18174774 0.86 PTGS2 (0.47) DHODHMKNK1MKNK2COMTPTGS2
SCHEMBL18174795 0.84 DHODH (0.46) DHODHMKNK1MKNK2COMTCKS1B
SCHEMBL18174739 0.84 APLNR (0.39) DHODHMKNK1MKNK2APLNRPTGS2
SCHEMBL18174764 0.84 CYP2A6 (0.41) MKNK1MKNK2PTGS2TDO2S1PR1
SCHEMBL10017308 0.83 CYP2A6 (0.41) TDO2S1PR1S1PR3CYP2A6METAP2
SCHEMBL18174766 0.82 TDO2 (0.37) COMTPTGS2TDO2S1PR1S1PR3
SCHEMBL18174777 0.82 CYP2A6 (0.40) DHODHS1PR1S1PR3CYP2A6
SCHEMBL18174786 0.82 DHODH (0.47) DHODHMKNK1MKNK2COMTPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9478750-B2 Anthracene derivative and organic electroluminescent element using the same JNC CORPORATION (JP) 2016-10-25 US disclosed
US-9478750-B2 Anthracene derivative and organic electroluminescent element using the same JNC CORPORATION (JP) 2016-10-25 US disclosed