SCHEMBL3634402

SCHEMBL3634402

O=CC(c1cccc(C(F)(F)F)c1)N1CCC(=NOC(=O)Nc2ccc(F)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
RAB9A P51151 3/20 0.39
GAA P10253 3/20 0.39
MAPT P10636 4/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
LMNA P02545 4/20 0.38
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 1/20 0.38
C5AR1 P21730 1/20 0.37
HPGDS O60760 1/20 0.36
NPY5R Q15761 1/20 0.36
HSD17B10 Q99714 1/20 0.36
UBE2M P61081 1/20 0.36
DCUN1D1 Q96GG9 1/20 0.36
SCN5A Q14524 1/20 0.36

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
SCHEMBL2294293 0.81 GRIN2B (0.50) KMT2ASMN1; SMN2RAB9AGAAMAPT
SCHEMBL2291227 0.79 HPGDS (0.53) KMT2ASMN1; SMN2POLBHPGDLMNA
SCHEMBL2294464 0.77 TRPV1 (0.44) KMT2ASMN1; SMN2RAB9AGAAMAPT
SCHEMBL2294335 0.77 RAB9A (0.58) KMT2ASMN1; SMN2RAB9AGAAMAPT
SCHEMBL2292379 0.77 TSHR (0.50) KMT2ASMN1; SMN2GAAMAPTPOLB
SCHEMBL2297093 0.76 KMT2A (0.54) KMT2ASMN1; SMN2RAB9AGAAMAPT
SCHEMBL2289626 0.76 TSHR (0.45) KMT2ASMN1; SMN2RAB9AGAAMAPT
SCHEMBL3640469 0.69 RAB9A (0.55) KMT2ASMN1; SMN2RAB9AGAAMAPT
SCHEMBL2291074 0.69 LMNA (0.53) KMT2ASMN1; SMN2RAB9AGAAMAPT
SCHEMBL2294071 0.69 ALDH1A1 (0.51) KMT2ASMN1; SMN2RAB9AGAAMAPT

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-2164326-A1 AMIDE COMPOUNDS AND THE USE THEREOF Euro-Celtique, S.A. (LU) 2010-03-24 EP disclosed
WO-2008150447-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2008-12-11 WO disclosed