SCHEMBL4375272

SCHEMBL4375272

CCOC(=O)OC1(Cc2ccccc2)CCN(C(=O)[C@@H](Cc2ccc(-c3ccccc3)cc2)N(C)C(=O)/C=C(\C)CC(C)(C)N)CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.35
ADORA1 P30542 2/20 0.34
P2RX7 Q99572 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
DPP4 P27487 1/20 0.33
CCKBR P32239 2/20 0.32
P2RY12 Q9H244 1/20 0.32
ALDH1A1 P00352 3/20 0.32
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
CYP2C9 P11712 1/20 0.32
MMEL1 Q495T6 1/20 0.32
CYP46A1 Q9Y6A2 1/20 0.32
OPRD1 P41143 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
HRH3 Q9Y5N1 1/20 0.30

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
SCHEMBL4382952 0.91 OPRD1 (0.38) GHSRADORA1P2RX7MEN1KMT2A
SCHEMBL4369760 0.88 GHSR (0.48) GHSRADORA1P2RX7DPP4CCKBR
SCHEMBL867813 0.88 LMNA (0.43) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL867814 0.88 LMNA (0.43) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL7856855 0.88 LMNA (0.43) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL13759959 0.84 ALDH1A1 (0.38) GHSRMEN1KMT2ANPC1RAB9A
SCHEMBL868492 0.83 GHSR (0.37) GHSRP2RX7MEN1KMT2ADPP4
SCHEMBL868493 0.83 GHSR (0.37) GHSRP2RX7MEN1KMT2ADPP4
SCHEMBL4385374 0.80 GHSR (0.40) GHSRDPP4OPRD1
SCHEMBL4369742 0.80 GHSR (0.48) GHSRMEN1KMT2ADPP4OPRD1

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-1077941-B1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2009-08-12 EP claimed