SCHEMBL6162213

SCHEMBL6162213

CC(C)(N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(Oc2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 10/20 0.54
OPRM1 P35372 1/20 0.54
PKM P14618 1/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ACE P12821 1/20 0.52
FPR2 P25090 1/20 0.51
CALCRL Q16602 1/20 0.49
KCNA5 P22460 1/20 0.49
KCNH2 Q12809 1/20 0.49
P2RY12 Q9H244 1/20 0.48

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
SCHEMBL6162222 1.00 GHSR (0.54) GHSROPRM1PKMMEN1KMT2A
Hydrochloric Acid SCHEMBL6159893 0.99 GHSR (0.53) GHSROPRM1PKMMEN1KMT2A
Hydrochloric Acid SCHEMBL6159888 0.99 GHSR (0.53) GHSROPRM1PKMMEN1KMT2A
SCHEMBL6160232 0.88 GHSR (0.55) GHSROPRM1PKMMEN1KMT2A
SCHEMBL6160217 0.88 GHSR (0.55) GHSROPRM1PKMMEN1KMT2A
Hydrochloric Acid SCHEMBL6161051 0.87 GHSR (0.54) GHSROPRM1MEN1KMT2AACE
Hydrochloric Acid SCHEMBL6161057 0.87 GHSR (0.54) GHSROPRM1MEN1KMT2AACE
SCHEMBL6164274 0.86 BCHE (0.60) GHSROPRM1MEN1KMT2AACE
SCHEMBL6161841 0.86 GHSR (0.54) GHSROPRM1PKMMEN1KMT2A
SCHEMBL6164270 0.86 BCHE (0.60) GHSROPRM1MEN1KMT2AACE

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-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP claimed