SCHEMBL6163362

SCHEMBL6163362

CC(C)(C)OC(=O)NC(C)(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1Cc2ccc(N)cc2C1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 2/20 0.50
CTSL P07711 5/20 0.48
CTSS P25774 1/20 0.48
CTSK P43235 1/20 0.48
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ACE P12821 2/20 0.46
TP53 P04637 1/20 0.46
ITGB2 P05107 1/20 0.45
ICAM1 P05362 1/20 0.45
ITGAL P20701 1/20 0.45
ERAP2 Q6P179 1/20 0.43
SSTR3 P32745 1/20 0.43

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
SCHEMBL6163371 1.00 TACR1 (0.50) TACR1CTSLCTSSCTSKMAPT
SCHEMBL6163734 0.94 TACR1 (0.48) TACR1CTSLCTSSCTSKMAPT
SCHEMBL6163736 0.94 TACR1 (0.48) TACR1CTSLCTSSCTSKMAPT
SCHEMBL6166772 0.87 MEN1 (0.47) TACR1CTSLCTSSCTSKMAPT
SCHEMBL6166766 0.87 MEN1 (0.47) TACR1CTSLCTSSCTSKMAPT
SCHEMBL6160909 0.86 CTSL (0.50) TACR1CTSLCTSSCTSKMAPT
SCHEMBL6161694 0.85 MEN1 (0.45) TACR1CTSLCTSSCTSKMAPT
SCHEMBL6163815 0.84 MEN1 (0.47) TACR1CTSLCTSSCTSKMAPT
SCHEMBL6163811 0.84 MEN1 (0.47) TACR1CTSLCTSSCTSKMAPT
SCHEMBL6162193 0.84 MEN1 (0.45) TACR1CTSLCTSSCTSKMAPT

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