SCHEMBL19975593

SCHEMBL19975593

COc1ccc(CC(=O)N2CCN(C)CCN(C(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.78

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.78
SMN1; SMN2 Q16637 2/20 0.68
GFER P55789 2/20 0.55
ALDH1A1 P00352 4/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
SIGMAR1 Q99720 1/20 0.54
LMNA P02545 1/20 0.53
KMT2A Q03164 4/20 0.53
HPGD P15428 4/20 0.53
MEN1 O00255 3/20 0.53
HSD17B10 Q99714 2/20 0.53
NPSR1 Q6W5P4 1/20 0.51
GPR183 P32249 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL9321597 0.88 MAPT (1.00) MAPTSMN1; SMN2GFERALDH1A1L3MBTL1
SCHEMBL2445002 0.82 SMN1; SMN2 (0.60) MAPTSMN1; SMN2GFERALDH1A1L3MBTL1
SCHEMBL19975592 0.81 MAPT (0.84) MAPTSMN1; SMN2GFERALDH1A1L3MBTL1
SCHEMBL2377690 0.81 SMN1; SMN2 (0.60) MAPTSMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL22800915 0.81 MEN1 (0.55) MAPTSMN1; SMN2LMNAKMT2AMEN1
SCHEMBL5064405 0.81 KMT2A (0.60) MAPTSMN1; SMN2GFERALDH1A1KMT2A
SCHEMBL19143990 0.81 MEN1 (0.55) MAPTSMN1; SMN2ALDH1A1L3MBTL1KMT2A
SCHEMBL4720508 0.80 HSD11B1 (0.60) SMN1; SMN2ALDH1A1L3MBTL1LMNAKMT2A
SCHEMBL10039879 0.80 ALDH1A1 (0.62) MAPTSMN1; SMN2ALDH1A1SIGMAR1LMNA
SCHEMBL14653337 0.80 ALDH1A1 (0.58) MAPTSMN1; SMN2ALDH1A1L3MBTL1LMNA

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
US-9920082-B2 Water-soluble complexing agents and corresponding lanthanide complexes CISBO BIOASSAYS (FR) 2018-03-20 US disclosed