SCHEMBL8488984

SCHEMBL8488984

CCCC([O])C(=O)N1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.47
CYP2C19 P33261 1/20 0.47
GAA P10253 1/20 0.46
RECQL P46063 1/20 0.46
TSHR P16473 4/20 0.46
HTT P42858 2/20 0.46
POLB P06746 2/20 0.45
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
LMNA P02545 1/20 0.44
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPT P10636 1/20 0.41
PKM P14618 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
SCHEMBL8483742 0.85 CYP3A4 (0.50) CYP3A4CYP2C19GAARECQLTSHR
SCHEMBL8487634 0.82 L3MBTL1 (0.42) GAAALDH1A1MEN1KMT2A
SCHEMBL5482918 0.81 CYP3A4 (0.47) CYP3A4CYP2C19GAARECQLTSHR
SCHEMBL8488986 0.81 CYP3A4 (0.47) CYP3A4CYP2C19GAARECQLTSHR
SCHEMBL20733007 0.81 CYP3A4 (0.59) CYP3A4CYP2C19GAARECQLTSHR
SCHEMBL8489070 0.81 L3MBTL1 (0.44) GAASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL21695522 0.80 TSHR (0.48) CYP3A4CYP2C19GAARECQLTSHR
SCHEMBL8392660 0.80 CYP3A4 (0.46) CYP3A4CYP2C19GAARECQLTSHR
Hydrochloric Acid SCHEMBL7869080 0.79 TSHR (0.47) CYP3A4CYP2C19GAARECQLTSHR
SCHEMBL21538501 0.77 HTT (0.47) CYP3A4CYP2C19GAATSHRHTT

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-5958837-A 2-(PHENYLMETHOXY OR CARBONYLOXY-(1,4-PHENYLENE)-),3-HALO,5-HALOALKYLPYRIDINES; HERBICIDES EFFECTING DESICCATION AND DEFOLIATION OF PLANTS; GOOD ACTIVITY AND BETTER TAILORED CONTROL OF WEEDS BASF AKTIENGESELLSCHAFT (DE) 1999-09-28 US disclosed
EP-0802904-B1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AG (DE) 1998-09-09 EP disclosed
CN-1172477-A Substituted 2 -phenylpyridines as herbicides BASF AG (DE) 1998-02-04 CN disclosed
WO-1996021647-A1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1996-07-18 WO disclosed