SCHEMBL27716611

SCHEMBL27716611

CC(C)(C)OOC(=O)c1ccc(N2CCC(c3ccccc3)CC2)cc1NC(=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 1/20 0.44
HDAC3 O15379 2/20 0.41
HDAC4 P56524 2/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC7 Q8WUI4 2/20 0.41
HDAC2 Q92769 2/20 0.41
HDAC10 Q969S8 2/20 0.41
HDAC11 Q96DB2 2/20 0.41
HDAC8 Q9BY41 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
HDAC9 Q9UKV0 2/20 0.41
HDAC5 Q9UQL6 2/20 0.41
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 3/20 0.40
TSHR P16473 2/20 0.40
POLB P06746 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 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
SCHEMBL2273007 0.90 MALT1 (0.45) MALT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL2275234 0.84 MALT1 (0.51) MALT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL27696869 0.80 ALDH1A1 (0.47) ALDH1A1HSD17B10TSHRPOLBTDP1
SCHEMBL27716702 0.78 SMN1; SMN2 (0.42) HDAC1ALDH1A1HSD17B10TSHRPOLB
SCHEMBL14428266 0.78 IP6K1 (0.45) MALT1HDAC3HDAC4HDAC1HDAC7
Aniline SCHEMBL27696813 0.75 MAPT (0.51) HDAC3HDAC1HDAC2ALDH1A1HSD17B10
SCHEMBL27716722 0.75 ALDH1A1 (0.41) ALDH1A1HSD17B10TSHRTDP1LMNA
SCHEMBL27716759 0.75 SERPINE1 (0.44) HDAC3HDAC1HDAC2ALDH1A1HSD17B10
SCHEMBL27716695 0.74 ALDH1A1 (0.40) ALDH1A1HSD17B10TSHRTDP1LMNA
SCHEMBL27848558 0.72 HDAC2 (0.51) HDAC3HDAC1HDAC2ALDH1A1HSD17B10

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