SCHEMBL9505261

SCHEMBL9505261

CCC(=O)Nc1cccc(OC(C)OCN)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 4/20 0.52
MTNR1A P48039 3/20 0.52
POLB P06746 2/20 0.51
NR4A1 P22736 1/20 0.51
RAB9A P51151 1/20 0.51
GAA P10253 1/20 0.50
SLC1A2 P43004 1/20 0.48
SLC1A1 P43005 1/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL9505403 0.86 SMN1; SMN2 (0.51) MTNR1BMTNR1APOLBNR4A1RAB9A
SCHEMBL13652569 0.83 MTNR1B (0.59) MTNR1BMTNR1APOLBNR4A1RAB9A
SCHEMBL9503172 0.78 MTNR1A (0.38) MTNR1BMTNR1AKMT2AMEN1ALDH1A1
SCHEMBL1141400 0.77 MTNR1B (0.81) MTNR1BMTNR1APOLBNR4A1RAB9A
SCHEMBL1142037 0.76 HTT (0.72) MTNR1BMTNR1APOLBNR4A1RAB9A
SCHEMBL10673426 0.75 MTNR1B (0.53) MTNR1BMTNR1APOLBNR4A1RAB9A
SCHEMBL10970617 0.74 RAB9A (0.85) POLBNR4A1RAB9AGAAKMT2A
SCHEMBL9503469 0.74 MTNR1A (0.41) MTNR1BMTNR1APOLBNR4A1RAB9A
SCHEMBL10294097 0.73 MTNR1B (0.58) MTNR1BMTNR1APOLBNR4A1RAB9A
SCHEMBL9795787 0.73 MTNR1A (0.46) MTNR1BMTNR1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0328968-B1 PROCESS FOR THE PREPARATION OF 4-ACYLAMINO-2-AMINO ALKOXY BENZENES HOECHST AKTIENGESELLSCHAFT (DE) 1993-05-12 EP disclosed
US-5047586-A Process for the preparation of 4-acylamino-2-aminoalkoxybenzenes HOECHST AKTIENGESELLSCHAFT (DE) 1991-09-10 US disclosed
EP-0328968-A2 Process for the preparation of 4-acylamino-2-amino alkoxy benzenes HOECHST AKTIENGESELLSCHAFT (DE) 1989-08-23 EP disclosed