SCHEMBL7769869

SCHEMBL7769869

CCCCOC(=O)NOCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.47
ACHE P22303 13/20 0.46
ALDH1A1 P00352 1/20 0.45
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ATM Q13315 1/20 0.42
PAM P19021 2/20 0.42
HCAR2 Q8TDS4 1/20 0.42

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
SCHEMBL2484625 0.85 EPHX1 (0.47) EPHX1ACHEALDH1A1NPC1RAB9A
SCHEMBL6576436 0.84 EPHX1 (0.53) EPHX1ACHEALDH1A1NPC1RAB9A
SCHEMBL2484624 0.84 EPHX1 (0.46) EPHX1ACHEALDH1A1NPC1RAB9A
SCHEMBL28481312 0.82 EPHX1 (0.52) EPHX1ACHEALDH1A1NPC1RAB9A
SCHEMBL4957666 0.76 EPHX1 (0.50) EPHX1ACHEALDH1A1NPC1RAB9A
SCHEMBL7715982 0.75 TSHR (0.43) EPHX1ALDH1A1SMN1; SMN2PAM
SCHEMBL1136659 0.75 SMN1; SMN2 (0.45) EPHX1ACHEALDH1A1NPC1RAB9A
SCHEMBL283132 0.74
SCHEMBL3819941 0.74 ACHE (0.59) ACHE
SCHEMBL7357013 0.74 TDP1 (0.58) ALDH1A1NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1115740-A1 SYNTHETIC PEPTIDES, CONJUGATION REAGENTS AND METHODS The Regents of the University of California (US) 2001-07-18 EP disclosed
WO-2000017226-A1 SYNTHETIC PEPTIDES, CONJUGATION REAGENTS AND METHODS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-03-30 WO disclosed
EP-0847241-A1 INFLUENCING THE ACTIVITY OF PLANT GROWTH REGULATORS Instituut voor Agrobiologisch en Bodemvruchtbaarheidsonderzoek ( AB-DLO) (NL) 1998-06-17 EP disclosed
WO-1997000614-A1 INFLUENCING THE ACTIVITY OF PLANT GROWTH REGULATORS INSTITUUT VOOR AGROBIOLOGISCH EN BODEMVRUCHTBAARHEIDSONDERZOEK (AB-DLO) (NL) 1997-01-09 WO disclosed