SCHEMBL4565372

SCHEMBL4565372

CC1(C2CC3(CCC(S(=O)(=O)c4ccc(-c5ccn6ccnc6c5)cc4)CC3)NCC2=O)CC1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.36
QPCT Q16769 1/20 0.34
NAMPT P43490 4/20 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
SCHEMBL4565386 0.80 FASN (0.40)
SCHEMBL3190627 0.66 FLT3 (0.48) PIK3C3NAMPT
SCHEMBL4565426 0.66 TGFBR1 (0.38) PIK3C3
SCHEMBL4541625 0.65 FASN (0.38)
SCHEMBL4565379 0.64 IRAK4 (0.34) PIK3C3
SCHEMBL4564596 0.64 CD74 (0.34)
SCHEMBL4565553 0.63 FGFR1 (0.37)
SCHEMBL4541263 0.63 HPGDS (0.33)
SCHEMBL4565577 0.63 SGK1 (0.46)
SCHEMBL14826051 0.62 PIK3C3 (0.51) PIK3C3QPCT

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-2637660-A1 FATTY ACID SYNTHASE INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2013-09-18 EP disclosed
WO-2012064642-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-05-18 WO disclosed