SCHEMBL6163357

SCHEMBL6163357

CC(C)(C)OC(=O)N[C@H](Cc1csc2ccccc12)C(=O)N1CCC(c2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.60
CTSS P25774 1/20 0.60
CTSK P43235 1/20 0.60
KMT2A Q03164 3/20 0.50
MC4R P32245 1/20 0.48
MAPK1 P28482 1/20 0.47
MEN1 O00255 1/20 0.47
CALCRL Q16602 10/20 0.46
CYP3A4 P08684 3/20 0.46
OPRD1 P41143 1/20 0.46
PABPC1 P11940 1/20 0.45

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
SCHEMBL6163361 1.00 CTSL (0.60) CTSLCTSSCTSKKMT2AMC4R
SCHEMBL6160248 0.92 CTSL (0.51) CTSLCTSSCTSKKMT2AMC4R
SCHEMBL6161491 0.88 CALCRL (0.49) CTSLCTSSCTSKCALCRLCYP3A4
SCHEMBL6161500 0.88 CALCRL (0.49) CTSLCTSSCTSKCALCRLCYP3A4
Hydrochloric Acid SCHEMBL6161553 0.87 CALCRL (0.49) CTSLCTSSCTSKCALCRLCYP3A4
Hydrochloric Acid SCHEMBL6161544 0.87 CALCRL (0.49) CTSLCTSSCTSKCALCRLCYP3A4
SCHEMBL2374758 0.83 KMT2A (0.68) CTSLCTSSCTSKKMT2AMAPK1
SCHEMBL2374766 0.83 KMT2A (0.68) CTSLCTSSCTSKKMT2AMAPK1
SCHEMBL5552595 0.83 CTSS (0.63) CTSLCTSSCTSKKMT2AMC4R
SCHEMBL8409751 0.81 KMT2A (0.56) CTSSCTSKKMT2AMAPK1PABPC1

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 disclosed