SCHEMBL4164927

SCHEMBL4164927

O=C(c1ccc(-n2ccc3c(F)cccc32)cc1)C1CCCN1C1CCNC1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 1/20 0.33
▸ HTR6 P50406 2/20 0.33
▸ RORC P51449 2/20 0.32
▸ GPR119 Q8TDV5 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SRC P12931 2/20 0.31
▸ BTK Q06187 2/20 0.31
▸ LYN P07948 1/20 0.31
▸ USP7 Q93009 1/20 0.30
▸ SSTR4 P31391 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CHRM1 P11229 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
SCHEMBL4164731 0.85 FFAR4 (0.33) MEN1MAPTRECQLKMT2ASSTR4
SCHEMBL4162409 0.85 FFAR4 (0.33) MEN1MAPTRECQLKMT2ASSTR4
SCHEMBL1813625 0.85 SLC6A4 (0.37) HTR6MAPT
SCHEMBL4013186 0.85 SLC6A4 (0.37) HTR6MAPT
SCHEMBL4169878 0.81 MGLL (0.42) HTR6MEN1MAPTRECQLKMT2A
SCHEMBL4158782 0.78 FFAR4 (0.39) MEN1MAPTRECQLKMT2A
SCHEMBL4167473 0.78 MGLL (0.35) —
SCHEMBL4166486 0.76 KDM2B (0.40) MEN1MAPTKMT2A
SCHEMBL1814722 0.74 KHK (0.44) —
SCHEMBL3846301 0.73 SCN9A (0.41) —

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-2074088-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS Wyeth (US) 2009-07-01 — — EP claimed
WO-2008045371-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-04-17 — — WO claimed
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