Sugi Predict

Sugi Predict / Compounds / SCHEMBL22385134

SCHEMBL22385134

SCHEMBL22385134

C[C@@H]1CCCCCC(C2CCCCC(N)CCCC2)CCCC1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.42
▸ ACHE P22303 1/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ THRB P10828 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ EPHX1 P07099 1/20 0.31
▸ MMP1 P03956 1/20 0.31
▸ MMP8 P22894 1/20 0.31

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
SCHEMBL21577837 1.00 ALDH1A1 (0.42) ALDH1A1ACHEKMT2ATHRBMEN1
SCHEMBL21335754 1.00 ALDH1A1 (0.42) ALDH1A1ACHEKMT2ATHRBMEN1
SCHEMBL19490021 0.97 ALDH1A1 (0.40) ALDH1A1ACHEKMT2ATHRBMEN1
SCHEMBL21655703 0.97 ALDH1A1 (0.40) ALDH1A1ACHEKMT2ATHRBMEN1
SCHEMBL19682923 0.97 ALDH1A1 (0.40) ALDH1A1ACHEKMT2ATHRBMEN1
SCHEMBL19682937 0.97 ALDH1A1 (0.40) ALDH1A1ACHEKMT2ATHRBMEN1
SCHEMBL22879281 0.97 ALDH1A1 (0.40) ALDH1A1ACHEKMT2ATHRBMEN1
SCHEMBL21968004 0.95 ALDH1A1 (0.42) ALDH1A1KMT2ATHRBMEN1
SCHEMBL21335755 0.95 ALDH1A1 (0.42) ALDH1A1KMT2ATHRBMEN1
SCHEMBL19490020 0.92 ALDH1A1 (0.37) ALDH1A1

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-3702357-A1 DIHYDROINDOLIZINONE DERIVATIVE ONO Pharmaceutical Co., Ltd. (JP) 2020-09-02 — — EP disclosed