Sugi Predict

Sugi Predict / Compounds / SCHEMBL22018671

SCHEMBL22018671

SCHEMBL22018671

CCCCCC(=O)NCC(=O)NC(C)C(=O)OCCCC

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 3/20 0.53
▸ FAAH O00519 11/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ GAA P10253 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ SLC6A5 Q9Y345 1/20 0.42
▸ RECQL P46063 1/20 0.41

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
SCHEMBL22018851 0.93 PSMB5 (0.47) PSMB5FAAHMEN1KMT2AGAA
SCHEMBL22019573 0.92 RECQL (0.47) PSMB5FAAHMEN1KMT2AMAPK1
SCHEMBL27175504 0.91 PSMB5 (0.45) PSMB5FAAHMEN1KMT2AMAPK1
SCHEMBL29211213 0.84 FAAH (0.61) FAAHMEN1KMT2AMAPK1
SCHEMBL7150166 0.84 FAAH (0.61) FAAHMEN1KMT2AMAPK1
SCHEMBL29211204 0.84 FAAH (0.61) FAAHMEN1KMT2AMAPK1
SCHEMBL7153526 0.84 FAAH (0.61) FAAHMEN1KMT2AMAPK1
SCHEMBL30876484 0.84 FAAH (0.61) FAAHMEN1KMT2AMAPK1
SCHEMBL29211215 0.84 FAAH (0.61) FAAHMEN1KMT2AMAPK1
SCHEMBL30876495 0.84 FAAH (0.61) FAAHMEN1KMT2AMAPK1

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
WO-2020102053-A1 METHODS OF PREPARING CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. (US) 2020-05-22 — — WO disclosed