SCHEMBL6162460

SCHEMBL6162460

CC(C)(N)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)N1CCC(c2cn(-c3ccccc3)c3ccccc23)CC1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CALCRL Q16602 1/20 0.49
GHSR Q92847 13/20 0.49
OPRM1 P35372 1/20 0.49
ACE P12821 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
PKM P14618 1/20 0.46

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
SCHEMBL6162452 1.00 CALCRL (0.49) CALCRLGHSROPRM1ACEMEN1
Hydrochloric Acid SCHEMBL6162455 0.99 CALCRL (0.48) CALCRLGHSROPRM1ACEMEN1
Hydrochloric Acid SCHEMBL6162463 0.99 CALCRL (0.48) CALCRLGHSROPRM1ACEMEN1
SCHEMBL6162087 0.88 MEN1 (0.53) CALCRLMEN1KMT2APKM
SCHEMBL6162094 0.88 MEN1 (0.53) CALCRLMEN1KMT2APKM
SCHEMBL6164896 0.88 GHSR (0.55) CALCRLGHSROPRM1ACEMEN1
SCHEMBL8550546 0.88 GHSR (0.55) CALCRLGHSROPRM1ACEMEN1
Hydrochloric Acid SCHEMBL6164291 0.87 GHSR (0.54) CALCRLGHSROPRM1ACEMEN1
Hydrochloric Acid SCHEMBL6162612 0.87 GHSR (0.54) CALCRLGHSROPRM1ACEMEN1
SCHEMBL6160232 0.86 GHSR (0.55) CALCRLGHSROPRM1ACEMEN1

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