SCHEMBL8207766

SCHEMBL8207766

CC(C)CCCC(C)(O)CCC(C)(C)O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
PTPN1 P18031 2/20 0.42
PTPN2 P17706 1/20 0.42
CDC25B P30305 1/20 0.42
MEN1 O00255 1/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX15 P16050 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.35
BLM P54132 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL8212898 0.93 MEN1 (0.47) ALDH1A1PTPN1PTPN2CDC25BMEN1
SCHEMBL11668697 0.87 ALOX15 (0.47) ALDH1A1PTPN1PTPN2CDC25BMEN1
SCHEMBL9067505 0.87 ALDH1A1 (0.56) ALDH1A1PTPN1PTPN2CDC25BMEN1
SCHEMBL81885 0.85 ALDH1A1 (0.50) ALDH1A1PTPN1PTPN2CDC25BMEN1
SCHEMBL5201000 0.84 MEN1 (0.60) PTPN1PTPN2CDC25BMEN1CYP3A4
SCHEMBL10749460 0.82 ALDH1A1 (0.47) ALDH1A1PTPN1PTPN2CDC25BMEN1
SCHEMBL5018789 0.81 PTPN1 (0.42) ALDH1A1PTPN1PTPN2CDC25BMEN1
SCHEMBL13619175 0.81 PTPN1 (0.42) ALDH1A1PTPN1PTPN2CDC25BMEN1
SCHEMBL22776 0.80 MEN1 (0.45) ALDH1A1PTPN1PTPN2CDC25BMEN1
SCHEMBL1329622 0.79 MEN1 (0.39) ALDH1A1PTPN1PTPN2CDC25BMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1050577-A1 Low voc cleanroom cleaning wipe AIR PRODUCTS AND CHEMICALS, INC. (US) 2000-11-08 EP claimed
EP-1050577-A1 Low voc cleanroom cleaning wipe AIR PRODUCTS AND CHEMICALS, INC. (US) 2000-11-08 EP disclosed
US-4117249-A SURFACTANTS ANIC, S.P.A. (IT) 1978-09-26 US disclosed