SCHEMBL7993292

SCHEMBL7993292

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.37
HIF1A Q16665 1/20 0.37
MMP13 P45452 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
KIF11 P52732 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA7 P43166 1/20 0.34
CA14 Q9ULX7 1/20 0.34
CTSS P25774 4/20 0.34
CTSK P43235 3/20 0.34
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
NCOR2 Q9Y618 1/20 0.33
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
AKT1 P31749 1/20 0.33

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
SCHEMBL7993296 1.00 CYP2C19 (0.37) CYP2C19HIF1AMMP13L3MBTL1KIF11
SCHEMBL7749261 0.90 MAPT (0.36) CYP2C19HIF1AMMP13L3MBTL1KIF11
SCHEMBL29084360 0.84 MAPT (0.36) CYP2C19HIF1AMMP13L3MBTL1KIF11
SCHEMBL1486196 0.84 MAPT (0.36) CYP2C19HIF1AMMP13L3MBTL1KIF11
SCHEMBL29084359 0.84 MAPT (0.36) CYP2C19HIF1AMMP13L3MBTL1KIF11
SCHEMBL9409814 0.83 CYP2C19 (0.36) CYP2C19HIF1AMMP13L3MBTL1CA12
SCHEMBL9409817 0.83 CYP2C19 (0.36) CYP2C19HIF1AMMP13L3MBTL1CA12
SCHEMBL7781163 0.82 ATM (0.41) L3MBTL1KIF11
SCHEMBL1486153 0.82 KMT2A (0.35) CYP2C19HIF1AMMP13L3MBTL1KIF11
SCHEMBL28541775 0.82 KMT2A (0.35) CYP2C19HIF1AMMP13L3MBTL1KIF11

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-0817629-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2000-03-08 EP disclosed
EP-0817629-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-01-14 EP disclosed