SCHEMBL28200469

SCHEMBL28200469

Cc1ccccc1-c1cc(N)cc2c1[nH]c1ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.53
PARP14 Q460N5 5/20 0.47
CYP1A2 P05177 3/20 0.45
CYP2C19 P33261 1/20 0.45
TNKS2 Q9H2K2 1/20 0.45
ABCB1 P08183 1/20 0.44
MAPT P10636 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
PARP1 P09874 2/20 0.43
MAPK14 Q16539 1/20 0.41
CDK4 P11802 1/20 0.41
CCND1 P24385 1/20 0.41
POLB P06746 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GABRP O00591 1/20 0.41

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
SCHEMBL28210907 0.89 PARP1 (0.50) KIF11PARP14MAPTMEN1KMT2A
SCHEMBL28059318 0.86 POLB (0.49) KIF11CYP1A2TNKS2MAPTMEN1
SCHEMBL1180982 0.83 KIF11 (0.59) KIF11CYP1A2CYP2C19TNKS2ABCB1
SCHEMBL27673124 0.83 APP (0.44) PARP14PARP1CDK4CCND1POLB
SCHEMBL27770093 0.83 BCHE (0.50) KIF11PARP14PARP1CDK4CCND1
SCHEMBL21647358 0.81 CDK4 (0.52) KIF11MAPTMEN1KMT2ACDK4
SCHEMBL29930364 0.81 CDK4 (0.52) KIF11MAPTMEN1KMT2ACDK4
SCHEMBL5810425 0.80 KIF11 (0.75) KIF11PARP14CYP1A2MAPTMEN1
SCHEMBL29119809 0.77 KIF11 (0.70) KIF11PARP14CYP1A2MAPTMEN1
SCHEMBL17999711 0.77 KIF11 (0.55) KIF11PARP14CYP1A2CYP2C19TNKS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107663169-A A kind of 6H naphtho-s [2,1,8,7 klmn] acridine derivatives and its application 北京鼎材科技有限公司 2018-02-06 CN disclosed