SCHEMBL4551536

SCHEMBL4551536

CON(C(=O)c1cc(Nc2cc(F)cc(N3CCCCC3)c2)cnc1C)c1ccc(N(C)C2CCOCC2)nc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
SETD2 Q9BYW2 1/20 0.33
SLC6A9 P48067 2/20 0.33
SLC6A5 Q9Y345 2/20 0.33
JAK2 O60674 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PDE4B Q07343 1/20 0.32
RAF1 P04049 3/20 0.32
BRAF P15056 3/20 0.32
EPHB4 P54760 4/20 0.32
PLAU P00749 1/20 0.32
EGFR P00533 1/20 0.32
MAPK10 P53779 1/20 0.31
MAPK7 Q13164 1/20 0.31
FGFR1 P11362 1/20 0.31

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
SCHEMBL4551481 0.99 SETD2 (0.34) SMN1; SMN2LMNASETD2SLC6A9SLC6A5
SCHEMBL4551942 0.92 FAAH (0.31) SETD2SLC6A9SLC6A5TDP1
SCHEMBL4551887 0.88 MAPK3 (0.35) SLC6A9SLC6A5MAPK1PDE4BPLAU
SCHEMBL4551650 0.86 PDE4B (0.40) SMN1; SMN2LMNASETD2MAPTMAPK1
SCHEMBL5490933 0.85 PDE4B (0.41) SETD2MAPTPDE4BRAF1BRAF
SCHEMBL5490098 0.81 MAPT (0.32) SMN1; SMN2SETD2SLC6A9SLC6A5JAK2
SCHEMBL5490026 0.81 CRHR1 (0.42) SLC6A9SLC6A5MAPK1
SCHEMBL5494096 0.80 CRHR1 (0.42)
SCHEMBL5495528 0.80 RPS6KA3 (0.35) SLC6A9SLC6A5
SCHEMBL4551762 0.79 RPS6KA3 (0.35)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035005-A2 THERAPY USING CYTOKINE INHIBITORS Kemia, INC. (US) 2009-03-18 EP disclosed
WO-2007146712-A2 THERAPY USING CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-12-21 WO disclosed
WO-2007056016-A2 BISAMIDE CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-05-18 WO disclosed