SCHEMBL27716618

SCHEMBL27716618

COC(=O)c1ccc(-c2ccccc2)cc1Nc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.67
ALOX15 P16050 1/20 0.67
AKR1C3 P42330 3/20 0.55
AKR1C2 P52895 3/20 0.55
ACLY P53396 4/20 0.53
NR4A2 P43354 2/20 0.51
SIRT2 Q8IXJ6 1/20 0.48
SIRT1 Q96EB6 1/20 0.48
EGFR P00533 1/20 0.48
KDM4E B2RXH2 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
GFER P55789 2/20 0.46
NGLY1 Q96IV0 1/20 0.46
POLB P06746 1/20 0.46
ATM Q13315 1/20 0.46
CXCR2 P25025 1/20 0.46
PTGER4 P35408 1/20 0.46

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
SCHEMBL4220421 0.86 MAPT (0.49) MAPTALOX15AKR1C3AKR1C2ACLY
SCHEMBL28649151 0.84 MAPT (0.81) MAPTALOX15SIRT2SIRT1KDM4E
SCHEMBL4223119 0.84 AKR1C3 (0.60) MAPTAKR1C3AKR1C2ACLYSIRT2
SCHEMBL27985224 0.84 SIRT2 (0.53) MAPTALOX15AKR1C3AKR1C2ACLY
SCHEMBL8529851 0.84 MAPT (0.74) MAPTALOX15AKR1C3AKR1C2SIRT2
SCHEMBL13877053 0.84 SLC6A4 (0.50) MAPTALOX15AKR1C3AKR1C2ACLY
SCHEMBL27388926 0.83 MAPT (0.69) MAPTALOX15AKR1C3AKR1C2SIRT2
SCHEMBL3236732 0.83 MAPT (0.69) MAPTALOX15AKR1C3AKR1C2SIRT2
SCHEMBL4217099 0.83 ABCG2 (0.46) MAPTALOX15AKR1C3AKR1C2ACLY
SCHEMBL25063305 0.82 MAPT (0.67) MAPTALOX15AKR1C3AKR1C2SIRT2

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