SCHEMBL6163598

SCHEMBL6163598

CC(C)(N)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)N1CCC(n2c(=O)[nH]c3ccccc32)CC1

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CALCRL Q16602 16/20 0.75
CYP3A4 P08684 8/20 0.60
RAMP1 O60894 1/20 0.51
GHSR Q92847 2/20 0.50
OPRM1 P35372 1/20 0.50
HSD11B1 P28845 1/20 0.49

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
SCHEMBL6163599 1.00 CALCRL (0.75) CALCRLCYP3A4RAMP1GHSROPRM1
SCHEMBL6164023 0.92 CALCRL (0.64) CALCRLCYP3A4RAMP1
SCHEMBL6163107 0.92 CALCRL (0.64) CALCRLCYP3A4RAMP1
SCHEMBL6159881 0.92 CALCRL (0.64) CALCRLCYP3A4
SCHEMBL6159873 0.92 CALCRL (0.64) CALCRLCYP3A4
Hydrochloric Acid SCHEMBL6161084 0.91 CALCRL (0.63) CALCRLCYP3A4GHSROPRM1
Hydrochloric Acid SCHEMBL6162625 0.91 CALCRL (0.63) CALCRLCYP3A4RAMP1
Hydrochloric Acid SCHEMBL6161566 0.91 CALCRL (0.63) CALCRLCYP3A4RAMP1
Hydrochloric Acid SCHEMBL6161092 0.91 CALCRL (0.63) CALCRLCYP3A4GHSROPRM1
SCHEMBL6164090 0.89 CALCRL (0.60) CALCRLCYP3A4GHSROPRM1

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 7 patents. 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
EP-0828754-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER INC. (US) 1998-03-18 EP claimed
WO-1996038471-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER INC. (US) 1996-12-05 WO claimed
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP disclosed
EP-0828754-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER INC. (US) 1998-03-18 EP disclosed
CN-1143647-A Dipeptides which promote release of growth hormone PFIZER (US) 1997-02-26 CN disclosed
WO-1996038471-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER INC. (US) 1996-12-05 WO disclosed