SCHEMBL9007891

SCHEMBL9007891

CCOCCCCCOCCCCCO

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
THRB P10828 1/20 0.56
HTT P42858 1/20 0.56
MAPT P10636 1/20 0.56
TSHR P16473 2/20 0.50
CYP4F2 P78329 1/20 0.48
CYP4A11 Q02928 1/20 0.48
LMNA P02545 2/20 0.46
HSD17B10 Q99714 1/20 0.46
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.41
USP2 O75604 1/20 0.39
ACHE P22303 5/20 0.38

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
SCHEMBL10009389 1.00 ALDH1A1 (0.57) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL21657309 0.97 MEN1 (0.60) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL11251719 0.97 MEN1 (0.60) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL6021998 0.97 MEN1 (0.60) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL3060254 0.97 ALDH1A1 (0.60) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL10941081 0.97 ALDH1A1 (0.60) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL427388 0.97
SCHEMBL4335363 0.97 ALDH1A1 (0.60) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL2952922 0.97 ALDH1A1 (0.60) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL10936372 0.97 ALDH1A1 (0.60) ALDH1A1MEN1KMT2ATHRBHTT

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
US-5571689-A Method of N-acylating peptide and proteins with diheteroatom substituted analogs of myristic acid WASHINGTON UNIVERSITY (US) 1996-11-05 US disclosed
EP-0441765-B1 Novel fatty acid analog enzyme substrates UNIV WASHINGTON (US) 1994-05-11 EP disclosed
US-5082967-A Myristolyation WASHINGTON UNIVERSITY (US) 1992-01-21 US disclosed
EP-0441765-A1 Novel fatty acid analog enzyme substrates WASHINGTON UNIVERSITY (US) 1991-08-14 EP disclosed