SCHEMBL9537378

SCHEMBL9537378

CCCCCN(CCCCC)C(=O)[C@@H](N)Cc1c[nH]cn1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 8/20 0.35
MC4R P32245 3/20 0.33
MC5R P33032 2/20 0.33
MC3R P41968 2/20 0.33

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
SCHEMBL9537377 1.00 CCKBR (0.35) CCKBRMC4RMC5RMC3R
SCHEMBL14244789 0.88 CNR1 (0.36)
SCHEMBL9903272 0.83 APOBEC3A (0.31)
Hydrochloric Acid SCHEMBL721032 0.81 DNM1 (0.40)
SCHEMBL18408792 0.79 LTA4H (0.36)
SCHEMBL15228058 0.78 XDH (0.39)
SCHEMBL15668776 0.78
SCHEMBL3632927 0.77
SCHEMBL19891851 0.77 CA1 (0.36)
SCHEMBL15348708 0.77

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0480969-A4 AMINO ACID ANALOG CCK ANTAGONISTS 1993-01-07 EP disclosed
EP-0480969-A1 AMINO ACID ANALOG CCK ANTAGONISTS ABBOTT LABORATORIES (US) 1992-04-22 EP disclosed