SCHEMBL7433464

SCHEMBL7433464

Cc1ccc(Cl)c(-c2nnnn2C(C(=O)OCc2ccccc2)C(=O)C(N)CC(=O)OC(C)(C)C)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 1/20 0.33
GHSR Q92847 2/20 0.32
BRD4 O60885 1/20 0.32
BRD2 P25440 1/20 0.32
BRD3 Q15059 1/20 0.32
SLC7A5 Q01650 1/20 0.32
MAPT P10636 2/20 0.31
CCKAR P32238 1/20 0.31
CCKBR P32239 1/20 0.31
DHODH Q02127 1/20 0.31
LTA4H P09960 1/20 0.31
CYP2C9 P11712 2/20 0.31
PTGER1 P34995 1/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL7442699 0.88 MAPT (0.35) MAP3K5GHSRSLC7A5MAPTCCKAR
SCHEMBL7435675 0.86 MAPT (0.37) GHSRMAPTCCKARCCKBRLTA4H
SCHEMBL7438488 0.86 CYP2C9 (0.34) SLC7A5MAPTDHODHLTA4HCYP2C9
SCHEMBL7441596 0.85 GHSR (0.34) GHSRSLC7A5MAPTCCKARCCKBR
SCHEMBL7433678 0.84 GHSR (0.37) GHSRMAPTCCKARCCKBRLTA4H
SCHEMBL7441643 0.84 CCKAR (0.34) MAP3K5GHSRSLC7A5MAPTCCKAR
SCHEMBL7439595 0.83 GHSR (0.36) MAP3K5GHSRSLC7A5MAPTCCKAR
SCHEMBL7441953 0.82 GHSR (0.35) MAP3K5GHSRBRD4BRD2BRD3
SCHEMBL7431147 0.81 MAPT (0.40) GHSRSLC7A5MAPTALDH1A1RAB9A
SCHEMBL7433296 0.79 CACNA1B (0.32) MAP3K5GHSRMAPTCCKARCCKBR

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-5710153-A INTERLEUKIN CONVERTING ENZYME INHIBITORS ONO PHRAMACEUTICAL CO., LTD. (JP) 1998-01-20 US disclosed
EP-0761680-A2 Tetrazole compounds having Interleukin-1beta converting enzyme inhibitory activity ONO PHARMACEUTICAL CO., LTD. (JP) 1997-03-12 EP disclosed