SCHEMBL13719645

SCHEMBL13719645

CCCCNC(=O)C1CCN(C(=O)c2ccc(Cl)cc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.65
ALDH1A1 P00352 1/20 0.62
EPHX2 P34913 1/20 0.58
MGLL Q99685 5/20 0.58
MAPT P10636 1/20 0.58
GAA P10253 2/20 0.57
CA12 O43570 1/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
CA9 Q16790 1/20 0.57
KMT2A Q03164 1/20 0.57
LMNA P02545 1/20 0.56
UBE2M P61081 1/20 0.56
DCUN1D1 Q96GG9 1/20 0.56
KDM4C Q9H3R0 1/20 0.55
TP53 P04637 1/20 0.55
THRB P10828 1/20 0.54
NPY5R Q15761 1/20 0.53

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
SCHEMBL8538865 0.88 KMT2A (0.68) EPHX2MGLLMAPTCA12CA1
SCHEMBL13720049 0.88 LMNA (0.65) POLBALDH1A1EPHX2KMT2ALMNA
SCHEMBL13719659 0.86 POLB (0.69) POLBALDH1A1EPHX2MGLLGAA
SCHEMBL8534116 0.80 LSS (0.49) POLBALDH1A1KMT2ALMNA
SCHEMBL13720036 0.79 MEN1 (0.77) POLBALDH1A1EPHX2MGLLCA12
SCHEMBL314316 0.78 MGLL (0.68) EPHX2MGLLMAPTCA12CA1
SCHEMBL22178702 0.77 GNAI3 (0.49)
SCHEMBL22179385 0.77 GNAI3 (0.49)
SCHEMBL22179330 0.77 GNAI3 (0.49)
SCHEMBL22179111 0.77 TLR2 (0.60)

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-7576245-B2 Fluorous tagging and scavenging reactants and methods of synthesis and use thereof FLUOROUS TECHNOLOGIES INCORPORATED (US) 2009-08-18 US disclosed
US-7576245-B2 Fluorous tagging and scavenging reactants and methods of synthesis and use thereof FLUOROUS TECHNOLOGIES INCORPORATED (US) 2009-08-18 US disclosed