Sugi Predict

Sugi Predict / Compounds / SCHEMBL7271675

SCHEMBL7271675

SCHEMBL7271675

CC(C)CC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)N(C)CCN(C)C(=O)C(C)C

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 19/20 0.51
▸ PSEN1 P49768 1/20 0.46
▸ PSEN2 P49810 1/20 0.46
▸ APH1B Q8WW43 1/20 0.46
▸ NCSTN Q92542 1/20 0.46
▸ APH1A Q96BI3 1/20 0.46
▸ PSENEN Q9NZ42 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
Hydrochloric Acid SCHEMBL7274189 0.99 REN (0.51) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL7271696 0.95 REN (0.55) REN
Hydrochloric Acid SCHEMBL7279916 0.94 REN (0.55) REN
SCHEMBL7277958 0.93 REN (0.51) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL7273807 0.93 REN (0.51) RENPSEN1PSEN2APH1BNCSTN
Hydrochloric Acid SCHEMBL7282482 0.93 REN (0.51) RENPSEN1PSEN2APH1BNCSTN
Hydrochloric Acid SCHEMBL7287287 0.93 REN (0.51) RENPSEN1PSEN2APH1BNCSTN
Hydrochloric Acid SCHEMBL7273795 0.91 REN (0.48) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL7281501 0.91 REN (0.53) RENPSEN1PSEN2APH1BNCSTN
SCHEMBL7280937 0.91 REN (0.49) RENPSEN1PSEN2APH1BNCSTN

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-0476515-A1 New amino acid derivatives, a process for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-03-25 — — EP disclosed