SCHEMBL7378307

SCHEMBL7378307

CO[C@H](CCC[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CC1CCCCC1)c1ccccn1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 5/20 0.34
ADORA2B P29275 5/20 0.34
GPR119 Q8TDV5 1/20 0.33
BMP1 P13497 5/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
NAMPT P43490 1/20 0.31
BACE1 P56817 2/20 0.31
CTSD P07339 1/20 0.31
CTSL P07711 1/20 0.31
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31
MMP2 P08253 1/20 0.31
FAAH O00519 1/20 0.31

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
SCHEMBL7378306 1.00 ADORA2A (0.34) ADORA2AADORA2BGPR119BMP1MEN1
SCHEMBL7378309 1.00 ADORA2A (0.34) ADORA2AADORA2BGPR119BMP1MEN1
SCHEMBL7369015 0.92 BMP1 (0.36) ADORA2AADORA2BGPR119BMP1MEN1
SCHEMBL7369146 0.92 BMP1 (0.36) ADORA2AADORA2BGPR119BMP1MEN1
SCHEMBL7369150 0.92 BMP1 (0.36) ADORA2AADORA2BGPR119BMP1MEN1
SCHEMBL7375102 0.90 ADORA2A (0.34) ADORA2AADORA2BGPR119BMP1MEN1
SCHEMBL7375103 0.90 ADORA2A (0.34) ADORA2AADORA2BGPR119BMP1MEN1
SCHEMBL7375107 0.90 ADORA2A (0.34) ADORA2AADORA2BGPR119BMP1MEN1
SCHEMBL7368920 0.87 ADORA2A (0.35) ADORA2AADORA2BGPR119MEN1HPGD
SCHEMBL7368916 0.87 ADORA2A (0.35) ADORA2AADORA2BGPR119MEN1HPGD

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
EP-0310015-A2 Renin-inhibiting dipeptides, process for their preparation, medicines containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1989-04-05 EP disclosed