SCHEMBL3259249

SCHEMBL3259249

Cn1nccc1-c1c(Cl)sc(NC(=O)C(c2ccccc2)C(NC(=O)O)C(C)(C)C)c1Cl

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
TSHR P16473 1/20 0.33
FFAR2 O15552 7/20 0.32
POLB P06746 1/20 0.32
ITGB1 P05556 1/20 0.31
ITGA2 P17301 1/20 0.31
MAPK1 P28482 1/20 0.31
ALDH1A1 P00352 2/20 0.30
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CTSA P10619 1/20 0.30
HDAC8 Q9BY41 2/20 0.30
CTSV O60911 1/20 0.30
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
CTSS P25774 1/20 0.30

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
SCHEMBL15397619 0.79 GLS (0.39) LMNAPOLBMAPK1ALDH1A1KDM4E
SCHEMBL2299075 0.79 GLS (0.42) LMNAPOLBSMN1; SMN2
SCHEMBL12385385 0.76 PCSK9 (0.36) POLBMAPK1CTSLCTSBCTSS
SCHEMBL4379140 0.70 AKT1 (0.40) LMNAMAPK1ALDH1A1CTSA
SCHEMBL4541679 0.67 AKT1 (0.41) ITGB1ITGA2ALDH1A1KDM4ERAB9A
SCHEMBL4541274 0.66 STAT3 (0.36) LMNAMAPK1CTSAHDAC8CTSV
SCHEMBL4554357 0.65 RORC (0.46) LMNAPOLBITGB1ALDH1A1NPC1
SCHEMBL4440845 0.65 HDAC1 (0.53) LMNAALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL4554171 0.64 DHPS (0.42) LMNAMAPK1ALDH1A1SMN1; SMN2CTSA
SCHEMBL2299249 0.64 ALDH1A1 (0.35) LMNAFFAR2ITGB1ITGA2ALDH1A1

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
WO-2010045309-A1 INHIBITORS OF AKT ACTIVITY GLAXOSMITHKLINE LLC (US) 2010-04-22 WO disclosed