SCHEMBL6161841

SCHEMBL6161841

CC(C)(N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(Nc2ccccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 11/20 0.54
OPRM1 P35372 1/20 0.54
ACE P12821 1/20 0.52
PKM P14618 1/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
FPR2 P25090 1/20 0.51
CALCRL Q16602 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
SCHEMBL6162005 1.00 GHSR (0.54) GHSROPRM1ACEPKMMEN1
Hydrochloric Acid SCHEMBL6168140 0.99 GHSR (0.53) GHSROPRM1ACEPKMMEN1
Hydrochloric Acid SCHEMBL6168134 0.99 GHSR (0.53) GHSROPRM1ACEPKMMEN1
SCHEMBL6160232 0.88 GHSR (0.55) GHSROPRM1ACEPKMMEN1
SCHEMBL6160217 0.88 GHSR (0.55) GHSROPRM1ACEPKMMEN1
SCHEMBL27501604 0.88 GHSR (0.50) GHSROPRM1ACEPKMMEN1
SCHEMBL6161560 0.87 MEN1 (0.57) ACEPKMMEN1KMT2AFPR2
Hydrochloric Acid SCHEMBL6161051 0.87 GHSR (0.54) GHSROPRM1ACEMEN1KMT2A
Hydrochloric Acid SCHEMBL6161057 0.87 GHSR (0.54) GHSROPRM1ACEMEN1KMT2A
SCHEMBL6162213 0.86 GHSR (0.54) GHSROPRM1ACEPKMMEN1

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