SCHEMBL27696643

SCHEMBL27696643

CCC(C)C(=O)c1cc(CC(N)=O)c2ccccn12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BAZ2B Q9UIF8 11/20 0.40
▸ BAZ2A Q9UIF9 11/20 0.40
▸ BRD4 O60885 2/20 0.40
▸ BRD9 Q9H8M2 2/20 0.40
▸ BRD2 P25440 1/20 0.37
▸ BRD3 Q15059 1/20 0.37
▸ ICMT O60725 3/20 0.37
▸ POLB P06746 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ HSP90AB1 P08238 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ TP53 P04637 1/20 0.34
▸ FNTA P49354 1/20 0.34
▸ FNTB P49356 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ GAA P10253 1/20 0.34

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
SCHEMBL27696466 0.77 ALDH1A1 (0.40) BAZ2BBAZ2ABRD4BRD9BRD2
SCHEMBL29882866 0.70 FNTA (0.48) BAZ2BBAZ2ABRD4BRD9BRD2
SCHEMBL17339103 0.69 BAZ2B (0.49) BAZ2BBAZ2ABRD4BRD9BRD2
SCHEMBL21202651 0.67 RAB9A (0.50) POLBKDM4EMAPTTP53ALDH1A1
SCHEMBL4268676 0.63 ICMT (0.42) ICMTPOLBKDM4ELMNAMAPK1
SCHEMBL3261349 0.63 ICMT (0.40) ICMTPOLBKDM4ELMNAMAPK1
SCHEMBL29882630 0.62 FNTA (0.48) BAZ2BBAZ2ABRD4BRD9KDM4E
SCHEMBL20229736 0.61 NPC1 (0.53) KDM4ELMNAMAPTTP53ALDH1A1
SCHEMBL20346870 0.61 PKM (0.47) KDM4ETP53ALDH1A1HPGD
SCHEMBL2590889 0.61 GABRA1 (0.44) ICMTPOLBKDM4ELMNAMAPK1

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
CN-101094852-A Substituted indolizines and derivatives as CNS active agents WYETH CORP (US) 2007-12-26 — — CN disclosed
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