SCHEMBL18174634

SCHEMBL18174634

Cc1cc(-c2ccncc2)ccc1-c1c2ccccc2c(-c2ccc(-c3ccncc3)cc2C)c2cc(-c3cccc4ccccc34)ccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.48
CA1 P00915 4/20 0.48
CA2 P00918 4/20 0.48
CA9 Q16790 4/20 0.48
MAPK14 Q16539 4/20 0.42
MAPK11 Q15759 2/20 0.42
MAPT P10636 2/20 0.41
MAPK1 P28482 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TLR8 Q9NR97 1/20 0.41
PIK3CA P42336 1/20 0.39
ENPP3 O14638 1/20 0.39
ENPP1 P22413 1/20 0.39

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
SCHEMBL18174596 0.87 MAPK9 (0.43) CA12CA1CA2CA9MAPK14
SCHEMBL18174664 0.87 PIK3CA (0.46) CA12CA1CA2CA9MAPK14
SCHEMBL18174574 0.87 PIK3CA (0.48) MAPK14MAPTKDM4EALDH1A1LMNA
SCHEMBL15977852 0.87 KDM4E (0.49) CA12CA1CA2CA9MAPK14
SCHEMBL10030058 0.85 KDM4E (0.48) CA12CA1CA2CA9MAPK14
SCHEMBL18174557 0.85 MAPK14 (0.43) CA12CA1CA2CA9MAPK14
SCHEMBL10030060 0.84 PIK3CA (0.46) CA12CA1CA2CA9MAPK14
SCHEMBL18174676 0.83 HTR2C (0.42) CA12CA1CA2CA9MAPT
SCHEMBL4263568 0.82 TLR8 (0.47) CA12CA1CA2CA9MAPK1
SCHEMBL10032215 0.81 MAPK9 (0.43) CA12CA1CA2CA9MAPK14

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