SCHEMBL27716638

SCHEMBL27716638

CC(C)(C)OOC(=O)c1ccc(CCCc2ccccc2)cc1NC(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
PLK1 P53350 7/20 0.44
PLK3 Q9H4B4 4/20 0.44
HDAC8 Q9BY41 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPK1 P28482 1/20 0.43
TRPV1 Q8NER1 1/20 0.42
LTC4S Q16873 1/20 0.42
MCL1 Q07820 1/20 0.42
BCL2A1 Q16548 1/20 0.42
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
PKM P14618 1/20 0.41
GRIK1 P39086 1/20 0.41
KMT2A Q03164 1/20 0.41
EHMT2 Q96KQ7 1/20 0.41
LMNA P02545 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
SCHEMBL27716624 0.98 PLK1 (0.47) HSD17B10TDP1ALDH1A1TSHRPLK1
SCHEMBL2274675 0.89 PLK1 (0.46) HSD17B10TDP1PLK1PLK3HDAC8
SCHEMBL27696859 0.87 PLK1 (0.42) HSD17B10TDP1ALDH1A1TSHRPLK1
SCHEMBL2271237 0.87 PLK1 (0.48) HSD17B10PLK1PLK3KDM4EMAPK1
SCHEMBL27696874 0.84 HSD17B10 (0.43) HSD17B10TDP1ALDH1A1TSHRPLK1
SCHEMBL2271236 0.81 PLK1 (0.60) TDP1PLK1PLK3HDAC8LTC4S
SCHEMBL27696833 0.81 HDAC1 (0.46) HSD17B10TDP1ALDH1A1TSHRKDM4E
SCHEMBL27716617 0.79 ALDH1A1 (0.46) HSD17B10TDP1ALDH1A1TSHRHDAC8
Aniline SCHEMBL27696813 0.79 MAPT (0.51) HSD17B10TDP1ALDH1A1TSHRKDM4E
SCHEMBL2272409 0.79 PLK1 (0.63) TDP1PLK1PLK3HDAC8LTC4S

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
CN-101094829-B novel anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO.,LTD. (JP) 2012-02-08 CN disclosed
CN-101094829-A Novel anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO LTD (JP) 2007-12-26 CN disclosed