SCHEMBL6159873

SCHEMBL6159873

CC(C)(N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CALCRL Q16602 11/20 0.64
DRD2 P14416 1/20 0.56
DRD4 P21917 1/20 0.56
SLC6A4 P31645 1/20 0.56
HTR7 P34969 1/20 0.56
HRH1 P35367 1/20 0.56
DRD3 P35462 1/20 0.56
HTR2B P41595 1/20 0.56
CYP3A4 P08684 7/20 0.52
AVPR1A P37288 1/20 0.51
UGCG Q16739 2/20 0.48
PLD2 O14939 3/20 0.48
PLD1 Q13393 3/20 0.48
CHRM1 P11229 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
SCHEMBL6159881 1.00 CALCRL (0.64) CALCRLDRD2DRD4SLC6A4HTR7
SCHEMBL6163599 0.92 CALCRL (0.75) CALCRLCYP3A4
SCHEMBL6163598 0.92 CALCRL (0.75) CALCRLCYP3A4
SCHEMBL6160869 0.89 CALCRL (0.58) CALCRLDRD2DRD4SLC6A4HTR7
SCHEMBL6160874 0.89 CALCRL (0.58) CALCRLDRD2DRD4SLC6A4HTR7
Hydrochloric Acid SCHEMBL6161092 0.86 CALCRL (0.63) CALCRLCYP3A4
Hydrochloric Acid SCHEMBL6161084 0.86 CALCRL (0.63) CALCRLCYP3A4
SCHEMBL6163107 0.86 CALCRL (0.64) CALCRLCYP3A4AVPR1APLD2PLD1
SCHEMBL6164023 0.86 CALCRL (0.64) CALCRLDRD2DRD4DRD3CYP3A4
Hydrochloric Acid SCHEMBL6162625 0.85 CALCRL (0.63) CALCRLCYP3A4AVPR1APLD2PLD1

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 8 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
WO-1996035713-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER, INC. (US) 1996-11-14 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
WO-1996038471-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER INC. (US) 1996-12-05 WO disclosed
WO-1996035713-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER, INC. (US) 1996-11-14 WO disclosed