SCHEMBL9318664

SCHEMBL9318664

CCOC(=O)C(Cc1ccccc1)N(C)C(=O)Cc1c(C)cc(C)cc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.43
ALDH1A1 P00352 4/20 0.42
TP53 P04637 1/20 0.42
TACR1 P25103 1/20 0.41
GAA P10253 1/20 0.41
NPY1R P25929 1/20 0.39
NPY2R P49146 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
HSD17B10 Q99714 1/20 0.38
EPHX2 P34913 1/20 0.37
PPARG P37231 1/20 0.37
ATM Q13315 1/20 0.37
MAPT P10636 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37

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
SCHEMBL9318712 0.91 NR3C1 (0.36) MMP8ALDH1A1TP53GAAL3MBTL1
SCHEMBL9318604 0.89 EPHX2 (0.41) ALDH1A1TP53L3MBTL1LMNAEPHX2
SCHEMBL9319910 0.89 GRM5 (0.42) ALDH1A1MEN1KMT2ALMNAPPARG
SCHEMBL9319230 0.84 EPHX2 (0.39) ALDH1A1TP53TACR1GAAL3MBTL1
SCHEMBL9318888 0.83 MMP8 (0.43) MMP8ALDH1A1TP53GAANPY1R
SCHEMBL8985598 0.83 MMP8 (0.43) MMP8ALDH1A1TP53GAANPY1R
SCHEMBL9318624 0.81 MMP8 (0.42) MMP8ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL9373738 0.81 NLRP3 (0.34) ALDH1A1L3MBTL1MEN1KMT2APOLB
SCHEMBL9318734 0.79 PRSS1 (0.51) MMP8TP53GAAL3MBTL1MEN1
SCHEMBL9320864 0.79 OPRM1 (0.51) ALDH1A1TP53SMN1; SMN2

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
US-5350861-A Insecticides, acaricides, fungicides, antimycotic agents BAYER AKTIENGESELLSCHAFT (DE) 1994-09-27 US disclosed