SCHEMBL7749261

SCHEMBL7749261

CC(C)(C)OC(=O)N(C(CS)C(N)=O)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
MMP13 P45452 1/20 0.34
HTR2C P28335 1/20 0.33
SLC6A4 P31645 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 0.33
KIF11 P52732 1/20 0.33
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32

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
SCHEMBL7993292 0.90 CYP2C19 (0.37) CYP2C19HIF1AMMP13L3MBTL1CA12
SCHEMBL7993296 0.90 CYP2C19 (0.37) CYP2C19HIF1AMMP13L3MBTL1CA12
SCHEMBL29084360 0.82 MAPT (0.36) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL29084359 0.82 MAPT (0.36) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL1486196 0.82 MAPT (0.36) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL9409817 0.81 CYP2C19 (0.36) CYP2C19HIF1ACYP1A2CYP2D6MMP13
SCHEMBL9409814 0.81 CYP2C19 (0.36) CYP2C19HIF1ACYP1A2CYP2D6MMP13
SCHEMBL28541775 0.80 KMT2A (0.35) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL1486153 0.80 KMT2A (0.35) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL2945259 0.79 SMN1; SMN2 (0.39) KMT2ACYP2C19MMP13HTR2CSLC6A4

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
EP-1068176-A1 CYSTEINE AMIDES AS FARNESYL TRANSFERASE INHIBITORS Jomaa, Hassan (DE) 2001-01-17 EP disclosed
WO-2000027803-A1 CYSTEINE AMIDES AS FARNESYL TRANSFERASE INHIBITORS JOMAA, HASSAN (DE) 2000-05-18 WO disclosed