SCHEMBL4868668

SCHEMBL4868668

CCN(C(=O)CNC(=O)N1CCCCc2ccccc21)c1cccc(F)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 6/20 0.47
AVPR1A P37288 2/20 0.44
OXTR P30559 1/20 0.44
PDE4B Q07343 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TP53 P04637 1/20 0.43
LMNA P02545 4/20 0.43
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
MAPT P10636 1/20 0.43
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL4870861 0.89 AVPR2 (0.49) AVPR2AVPR1AOXTRPDE4BMEN1
SCHEMBL14089575 0.89 AVPR2 (0.49) AVPR2AVPR1AOXTRMEN1KMT2A
SCHEMBL4872578 0.84 AVPR2 (0.52) AVPR2PDE4BMEN1KMT2ATP53
SCHEMBL4871198 0.83 LMNA (0.45) AVPR2TP53LMNAMAPTPOLB
SCHEMBL4867202 0.83 AVPR2 (0.46) AVPR2AVPR1AOXTRMEN1KMT2A
SCHEMBL4870682 0.82 AVPR2 (0.51) AVPR2PDE4BMEN1KMT2ATP53
SCHEMBL4863033 0.80 AVPR2 (0.48) AVPR2AVPR1AOXTRMEN1KMT2A
SCHEMBL4870210 0.79 TP53 (0.53) AVPR2AVPR1AOXTRTP53LMNA
SCHEMBL4865138 0.78 AVPR2 (0.46) AVPR2AVPR1AOXTRMEN1KMT2A
SCHEMBL4861652 0.77 TP53 (0.47) AVPR2AVPR1APDE4BMEN1KMT2A

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
US-7368444-B2 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-06 US claimed
EP-1475368-A1 N-CARBAMOYL NITROGEN-CONTAINING FUSED RING COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-11-10 EP disclosed