SCHEMBL6162859

SCHEMBL6162859

CC(C)(C)OC(=O)NC(C)(C)C(=O)NC(Cc1cccc2ccccc12)C(=O)N1CCC(c2ccccc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.49
CTSK P43235 1/20 0.49
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
MAPK1 P28482 1/20 0.44
CCR1 P32246 5/20 0.42
CYP3A4 P08684 1/20 0.41
CALCRL Q16602 1/20 0.41
MC4R P32245 1/20 0.41
PABPC1 P11940 1/20 0.40
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
HPN P05981 1/20 0.39
HGFAC Q04756 1/20 0.39
ST14 Q9Y5Y6 1/20 0.39

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
SCHEMBL6162850 1.00 CTSS (0.49) CTSSCTSKKMT2AMEN1MAPK1
SCHEMBL6160248 0.86 CTSL (0.51) CTSSCTSKKMT2AMEN1CYP3A4
SCHEMBL6161942 0.85 CYP3A4 (0.47) CCR1CYP3A4CALCRLHPNHGFAC
Hydrochloric Acid SCHEMBL6162214 0.84 CYP3A4 (0.46) CCR1CYP3A4CALCRLMC4RHPN
Hydrochloric Acid SCHEMBL6162218 0.84 CYP3A4 (0.46) CCR1CYP3A4CALCRLMC4RHPN
SCHEMBL6163662 0.83 CTSS (0.61) CTSSCTSKCYP3A4
SCHEMBL6163670 0.83 CTSS (0.61) CTSSCTSKCYP3A4
SCHEMBL6163768 0.82 KMT2A (0.43) KMT2AMEN1MAPK1CCR1PABPC1
SCHEMBL6163772 0.82 KMT2A (0.43) KMT2AMEN1MAPK1CCR1PABPC1
SCHEMBL6160376 0.82 CALCRL (0.66) CYP3A4CALCRL

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